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odanacatib
Description
odanacatib: a selective inhibitor of cathepsin K for the treatment of post-menopausal osteoporosis; structure in first source [MeSH]
Cross-References
ID Source | ID |
PubMed CID | 10152654 |
CHEMBL ID | 481611 |
SCHEMBL ID | 1496266 |
MeSH ID | M0519172 |
Synonyms (58)
Synonym |
HY-10042 |
CAS:603139-19-1;ODANACATIB |
mk-0822;mk 0822;mk0822 |
bdbm50255753 |
odanacatib |
mk-0822 |
mk-0822a |
603139-19-1 |
odanacatib (jan/usan) |
D08955 |
CHEMBL481611 , |
mk0822 |
(2s)-n-(1-cyanocyclopropyl)-4-fluoro-4-methyl-2-(((1s)-2,2,2-trifluoro-1-(4'-(methylsulfonyl)(1,1'-biphenyl)-4-yl)ethyl)amino)pentanamide |
pentanamide, n-(1-cyanocyclopropyl)-4-fluoro-4-methyl-2-(((1s)-2,2,2-trifluoro-1-(4'-(methylsulfonyl)(1,1'-biphenyl)-4-yl)ethyl)amino)-, (2s)- |
mk 0822 |
odanacatib [usan:inn] |
l-1037536 |
unii-n673f6w2vh |
n673f6w2vh , |
BCP9001020 |
BCPP000141 |
NCGC00346637-01 |
CS-0277 |
(2s)-n-(1-cyanocyclopropyl)-4-fluoro-4-methyl-2-[[(1s)-2,2,2-trifluoro-1-[4'-(methylsulfonyl)[1,1'-biphenyl]-4-yl]ethyl]amino]pentanamide |
S1115 |
AKOS015900719 |
odanacatib [mi] |
odanacatib [jan] |
odanacatib [usan] |
odanacatib [who-dd] |
odanacatib [mart.] |
odanacatib [inn] |
c25h27f4n3o3s |
gtpl6478 |
(2s)-n-(1-cyanocyclopropyl)-4-fluoro-4-methyl-2-[[(1s)-2,2,2-trifluoro-1-[4-(4-methylsulfonylphenyl)phenyl]ethyl]amino]pentanamide |
smr004676504 |
MLS006010197 |
n1-(1-cyanocyclopropyl)-4-fluoro-n2-{(1s)-2,2,2-trifluoro-1-[4'-(methylsulfonyl)-1,1'-biphenyl-4-yl]ethyl}-l-leucinamide |
n1-(1-cyanocyclopropyl)-4-fluoro-n2-{(1s)-2,2,2-trifluoro-1-[4'-(methyl sulfonyl)-1,1'-biphenyl-4-yl]ethyl}-l-leucinamide |
n-(1-cyanocyclopropyl)-4-fluoro-n2-{(1s)-2,2,2-trifluoro-1-[4'-(methylsulfonyl)biphenyl-4-yl]ethyl}-l-leucinamide |
mfcd11042419 |
SCHEMBL1496266 |
odanacatib (mk-0822) |
(s)-n-(1-cyanocyclopropyl)-4-fluoro-4-methyl-2-((s)-2,2,2-trifluoro-1-(4'-(methylsulfonyl)biphenyl-4-yl)ethylamino)pentanamide |
AC-27468 |
DTXSID40209075 |
odanacatib (mk 0822) |
J-690332 |
EX-A552 |
SW219669-1 |
DB06670 |
odanacatib (mk0822) |
AS-19562 |
Q2014070 |
(s)-n-(1-cyanocyclopropyl)-4-fluoro-4-methyl-2-(((s)-2,2,2-trifluoro-1-(4'-(methylsulfonyl)-[1,1'-biphenyl]-4-yl)ethyl)amino)pentanamide |
CCG-269888 |
nsc-766811 |
nsc766811 |
Protein Targets (12)
Potency Measurements
Inhibition Measurements
Bioassays (121)
Assay ID | Title | Year | Journal | Article |
AID1347154 | Primary screen GU AMC qHTS for Zika virus inhibitors | 2020 | Proceedings of the National Academy of Sciences of the United States of America, 12-08, Volume: 117, Issue:49 ISSN: 1091-6490 | Therapeutic candidates for the Zika virus identified by a high-throughput screen for Zika protease inhibitors. |
AID1347090 | qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for DAOY cells | 2018 | Oncotarget, Jan-12, Volume: 9, Issue:4 ISSN: 1949-2553 | Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing. |
AID1347106 | qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for control Hh wild type fibroblast cells | 2018 | Oncotarget, Jan-12, Volume: 9, Issue:4 ISSN: 1949-2553 | Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing. |
AID1347091 | qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for SJ-GBM2 cells | 2018 | Oncotarget, Jan-12, Volume: 9, Issue:4 ISSN: 1949-2553 | Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing. |
AID1296008 | Cytotoxic Profiling of Annotated Libraries Using Quantitative High-Throughput Screening | 2020 | SLAS discovery : advancing life sciences R & D, 01, Volume: 25, Issue:1 ISSN: 2472-5560 | Cytotoxic Profiling of Annotated and Diverse Chemical Libraries Using Quantitative High-Throughput Screening. |
AID1347101 | qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for BT-12 cells | 2018 | Oncotarget, Jan-12, Volume: 9, Issue:4 ISSN: 1949-2553 | Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing. |
AID1347108 | qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for Rh41 cells | 2018 | Oncotarget, Jan-12, Volume: 9, Issue:4 ISSN: 1949-2553 | Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing. |
AID1347103 | qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for OHS-50 cells | 2018 | Oncotarget, Jan-12, Volume: 9, Issue:4 ISSN: 1949-2553 | Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing. |
AID1347105 | qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for MG 63 (6-TG R) cells | 2018 | Oncotarget, Jan-12, Volume: 9, Issue:4 ISSN: 1949-2553 | Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing. |
AID1347096 | qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for U-2 OS cells | 2018 | Oncotarget, Jan-12, Volume: 9, Issue:4 ISSN: 1949-2553 | Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing. |
AID1508630 | Primary qHTS for small molecule stabilizers of the endoplasmic reticulum resident proteome: Secreted ER Calcium Modulated Protein (SERCaMP) assay | 2021 | Cell reports, 04-27, Volume: 35, Issue:4 ISSN: 2211-1247 | A target-agnostic screen identifies approved drugs to stabilize the endoplasmic reticulum-resident proteome. |
AID1347107 | qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for Rh30 cells | 2018 | Oncotarget, Jan-12, Volume: 9, Issue:4 ISSN: 1949-2553 | Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing. |
AID1347094 | qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for BT-37 cells | 2018 | Oncotarget, Jan-12, Volume: 9, Issue:4 ISSN: 1949-2553 | Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing. |
AID1347095 | qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for NB-EBc1 cells | 2018 | Oncotarget, Jan-12, Volume: 9, Issue:4 ISSN: 1949-2553 | Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing. |
AID1346986 | P-glycoprotein substrates identified in KB-3-1 adenocarcinoma cell line, qHTS therapeutic library screen | 2019 | Molecular pharmacology, 11, Volume: 96, Issue:5 ISSN: 1521-0111 | A High-Throughput Screen of a Library of Therapeutics Identifies Cytotoxic Substrates of P-glycoprotein. |
AID1347098 | qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for SK-N-SH cells | 2018 | Oncotarget, Jan-12, Volume: 9, Issue:4 ISSN: 1949-2553 | Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing. |
AID1347102 | qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for Rh18 cells | 2018 | Oncotarget, Jan-12, Volume: 9, Issue:4 ISSN: 1949-2553 | Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing. |
AID1347097 | qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for Saos-2 cells | 2018 | Oncotarget, Jan-12, Volume: 9, Issue:4 ISSN: 1949-2553 | Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing. |
AID1346987 | P-glycoprotein substrates identified in KB-8-5-11 adenocarcinoma cell line, qHTS therapeutic library screen | 2019 | Molecular pharmacology, 11, Volume: 96, Issue:5 ISSN: 1521-0111 | A High-Throughput Screen of a Library of Therapeutics Identifies Cytotoxic Substrates of P-glycoprotein. |
AID1347082 | qHTS for Inhibitors of the Functional Ribonucleoprotein Complex (vRNP) of Lassa (LASV) Arenavirus: LASV Primary Screen - GLuc reporter signal | 2020 | Antiviral research, 01, Volume: 173ISSN: 1872-9096 | A cell-based, infectious-free, platform to identify inhibitors of lassa virus ribonucleoprotein (vRNP) activity. |
AID1745845 | Primary qHTS for Inhibitors of ATXN expression | 2022 | The Journal of biological chemistry, 08, Volume: 298, Issue:8 ISSN: 1083-351X | |
AID1347092 | qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for A673 cells | 2018 | Oncotarget, Jan-12, Volume: 9, Issue:4 ISSN: 1949-2553 | Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing. |
AID1347100 | qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for LAN-5 cells | 2018 | Oncotarget, Jan-12, Volume: 9, Issue:4 ISSN: 1949-2553 | Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing. |
AID1347089 | qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for TC32 cells | 2018 | Oncotarget, Jan-12, Volume: 9, Issue:4 ISSN: 1949-2553 | Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing. |
AID1347093 | qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for SK-N-MC cells | 2018 | Oncotarget, Jan-12, Volume: 9, Issue:4 ISSN: 1949-2553 | Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing. |
AID1347083 | qHTS for Inhibitors of the Functional Ribonucleoprotein Complex (vRNP) of Lassa (LASV) Arenavirus: Viability assay - alamar blue signal for LASV Primary Screen | 2020 | Antiviral research, 01, Volume: 173ISSN: 1872-9096 | A cell-based, infectious-free, platform to identify inhibitors of lassa virus ribonucleoprotein (vRNP) activity. |
AID1347104 | qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for RD cells | 2018 | Oncotarget, Jan-12, Volume: 9, Issue:4 ISSN: 1949-2553 | Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing. |
AID1347086 | qHTS for Inhibitors of the Functional Ribonucleoprotein Complex (vRNP) of Lymphocytic Choriomeningitis Arenaviruses (LCMV): LCMV Primary Screen - GLuc reporter signal | 2020 | Antiviral research, 01, Volume: 173ISSN: 1872-9096 | A cell-based, infectious-free, platform to identify inhibitors of lassa virus ribonucleoprotein (vRNP) activity. |
AID1347099 | qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for NB1643 cells | 2018 | Oncotarget, Jan-12, Volume: 9, Issue:4 ISSN: 1949-2553 | Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing. |
AID1512168 | Antitrypanosomal activity against Trypanosoma cruzi Y strain amastigotes infected in human U2OS cells assessed as parasite growth inhibition after 72 hrs post infection by DRAQ5 staining based analysis | 2019 | Bioorganic & medicinal chemistry, 11-15, Volume: 27, Issue:22 ISSN: 1464-3391 | Synthesis and structure-activity relationship of nitrile-based cruzain inhibitors incorporating a trifluoroethylamine-based P2 amide replacement. |
AID1918201 | Inhibition of Cathepsin K (unknown origin) assessed as inhibition of AFC release using sequence LR labelled with AFC as substrate by fluorescence based analysis | 2022 | Bioorganic & medicinal chemistry, Nov-15, Volume: 74ISSN: 1464-3391 | Discovery of selective covalent cathepsin K inhibitors containing novel 4-cyanopyrimidine warhead based on quantum chemical calculations and binding mode analysis. |
AID314224 | Inhibition of cathepsin V | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID314221 | Inhibition of cathepsin L | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID482899 | Selectivity for cathepsin K over cathepsin L | 2010 | Journal of medicinal chemistry, Jun-10, Volume: 53, Issue:11 ISSN: 1520-4804 | Emerging targets in osteoporosis disease modification. |
AID367447 | Clearance in rat at 2 to 5 mg/kg, iv | 2009 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 19, Issue:3 ISSN: 1464-3405 | Investigation of ketone warheads as alternatives to the nitrile for preparation of potent and selective cathepsin K inhibitors. |
AID1572834 | Inhibition of MMP2 in mouse Primary chondrocytes derived after 2 passages at 1 uM after 24 hrs by Coomassie blue staining-based zymography assay | 2019 | Bioorganic & medicinal chemistry, 03-15, Volume: 27, Issue:6 ISSN: 1464-3391 | Design, synthesis and biological evaluation of inhibitors of cathepsin K on dedifferentiated chondrocytes. |
AID367439 | Inhibition of humanized rabbit cathepsin K | 2009 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 19, Issue:3 ISSN: 1464-3405 | Investigation of ketone warheads as alternatives to the nitrile for preparation of potent and selective cathepsin K inhibitors. |
AID1918202 | Inhibition of Cathepsin K (unknown origin) assessed as inhibition of AFC release at 1 uM using sequence LR labelled with AFC as substrate by fluorescence based analysis | 2022 | Bioorganic & medicinal chemistry, Nov-15, Volume: 74ISSN: 1464-3391 | Discovery of selective covalent cathepsin K inhibitors containing novel 4-cyanopyrimidine warhead based on quantum chemical calculations and binding mode analysis. |
AID314219 | Inhibition of humanized rabbit cathepsin K | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID569577 | Selectivity ratio of IC50 for human cathepsin F to IC50 for human cathepsin K | 2011 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 21, Issue:3 ISSN: 1464-3405 | Difluoroethylamines as an amide isostere in inhibitors of cathepsin K. |
AID458224 | Selectivity ratio of IC50 for human cathepsin B to IC50 for humanized rabbit cathepsin K | 2010 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 20, Issue:3 ISSN: 1464-3405 | The discovery of MK-0674, an orally bioavailable cathepsin K inhibitor. |
AID367441 | Selectivity ratio of IC50 for human cathepsin S to IC50 for humanized rabbit cathepsin K | 2009 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 19, Issue:3 ISSN: 1464-3405 | Investigation of ketone warheads as alternatives to the nitrile for preparation of potent and selective cathepsin K inhibitors. |
AID314237 | Metabolic stability in human hepatocyte at 20 uM after 2 hrs assessed as recovery of parent compound | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID367443 | Half life in rat at 2 to 5 mg/kg, iv | 2009 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 19, Issue:3 ISSN: 1464-3405 | Investigation of ketone warheads as alternatives to the nitrile for preparation of potent and selective cathepsin K inhibitors. |
AID367440 | Selectivity ratio of IC50 for human cathepsin L to IC50 for humanized rabbit cathepsin K | 2009 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 19, Issue:3 ISSN: 1464-3405 | Investigation of ketone warheads as alternatives to the nitrile for preparation of potent and selective cathepsin K inhibitors. |
AID1918207 | Selectivity index, ratio of IC50 for Cathepsin B (unknown origin) to IC50 for Cathepsin K (unknown origin) by fluorescence based analysis | 2022 | Bioorganic & medicinal chemistry, Nov-15, Volume: 74ISSN: 1464-3391 | Discovery of selective covalent cathepsin K inhibitors containing novel 4-cyanopyrimidine warhead based on quantum chemical calculations and binding mode analysis. |
AID569574 | Half life in dog at 5 mg/kg, po or 1 mg/kg, iv | 2011 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 21, Issue:3 ISSN: 1464-3405 | Difluoroethylamines as an amide isostere in inhibitors of cathepsin K. |
AID314223 | Inhibition of cathepsin F | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID314242 | Volume of distribution at steady state in rat at 10 mg/kg, po | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID1572831 | Inhibition of cathepsin K in mouse Primary chondrocytes derived after 2 passages at 1 uM after 24 hrs by Coomassie blue staining-based zymography assay | 2019 | Bioorganic & medicinal chemistry, 03-15, Volume: 27, Issue:6 ISSN: 1464-3391 | Design, synthesis and biological evaluation of inhibitors of cathepsin K on dedifferentiated chondrocytes. |
AID482443 | Antiosteoporotic activity in patient with osteoporosis assessed as increase in lumbar spine bone mineral density at 50 mg/kg, po administered weekly for 24 months relative to placebo control | 2010 | Journal of medicinal chemistry, Jun-10, Volume: 53, Issue:11 ISSN: 1520-4804 | Emerging targets in osteoporosis disease modification. |
AID699423 | Inhibition of human recombinant CatK assessed as suppression of enzyme-mediated Z-Phe-Arg-AMC cleavage incubated for 1 hrs by QFRET assay | 2012 | Journal of medicinal chemistry, Jul-26, Volume: 55, Issue:14 ISSN: 1520-4804 | (1R,2R)-N-(1-cyanocyclopropyl)-2-(6-methoxy-1,3,4,5-tetrahydropyrido[4,3-b]indole-2-carbonyl)cyclohexanecarboxamide (AZD4996): a potent and highly selective cathepsin K inhibitor for the treatment of osteoarthritis. |
AID314233 | Inhibition of cathepsin S in human ramos cells | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID482895 | Inhibition of cathepsin K | 2010 | Journal of medicinal chemistry, Jun-10, Volume: 53, Issue:11 ISSN: 1520-4804 | Emerging targets in osteoporosis disease modification. |
AID314220 | Inhibition of cathepsin B | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID482423 | Selectivity for cathepsin K over cathepsin F | 2010 | Journal of medicinal chemistry, Jun-10, Volume: 53, Issue:11 ISSN: 1520-4804 | Emerging targets in osteoporosis disease modification. |
AID569573 | Oral bioavailability in dog at 1 mg/kg, iv | 2011 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 21, Issue:3 ISSN: 1464-3405 | Difluoroethylamines as an amide isostere in inhibitors of cathepsin K. |
AID314239 | Oral bioavailability in rat at 10 mg/kg | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID482444 | Antiosteoporotic activity in patient with osteoporosis assessed as increase in hip bone mineral density at 50 mg/kg, po administered weekly for 24 months relative to placebo control | 2010 | Journal of medicinal chemistry, Jun-10, Volume: 53, Issue:11 ISSN: 1520-4804 | Emerging targets in osteoporosis disease modification. |
AID458485 | Decrease in bone resorption assessed as corrected bone resorption measured as ratio of bone resorption IC50 x humanized rabbit cathepsin K IC50 to rabbit cathepsin K IC50 equation | 2010 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 20, Issue:3 ISSN: 1464-3405 | The discovery of MK-0674, an orally bioavailable cathepsin K inhibitor. |
AID699425 | Inhibition of human recombinant CatS assessed as suppression of enzyme-mediated Z-Val-Val-Arg-AMC cleavage by QFRET assay | 2012 | Journal of medicinal chemistry, Jul-26, Volume: 55, Issue:14 ISSN: 1520-4804 | (1R,2R)-N-(1-cyanocyclopropyl)-2-(6-methoxy-1,3,4,5-tetrahydropyrido[4,3-b]indole-2-carbonyl)cyclohexanecarboxamide (AZD4996): a potent and highly selective cathepsin K inhibitor for the treatment of osteoarthritis. |
AID703270 | Inhibition of osteoclastogenesis in human bone marrow-derived stem cells assessed as reduction of pit formation by measuring TRACP5b activity after 7 days by bone TRAP assay | 2012 | Journal of medicinal chemistry, Oct-25, Volume: 55, Issue:20 ISSN: 1520-4804 | Pharmacokinetic benefits of 3,4-dimethoxy substitution of a phenyl ring and design of isosteres yielding orally available cathepsin K inhibitors. |
AID314250 | Volume of distribution at steady state in rhesus monkey at 5 mg/kg, po | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID314225 | Inhibition of cathepsin C | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID569576 | Selectivity ratio of IC50 for human cathepsin B to IC50 for human cathepsin K | 2011 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 21, Issue:3 ISSN: 1464-3405 | Difluoroethylamines as an amide isostere in inhibitors of cathepsin K. |
AID703434 | Inhibition of cathepsin-k | 2012 | Journal of medicinal chemistry, Oct-25, Volume: 55, Issue:20 ISSN: 1520-4804 | Pharmacokinetic benefits of 3,4-dimethoxy substitution of a phenyl ring and design of isosteres yielding orally available cathepsin K inhibitors. |
AID1572829 | Inhibition of cathepsin K in mouse Primary chondrocytes derived after 2 passages at 0.1 to 1 uM using Z-GPR-4MbetaNA as substrate by fluorescence assay relative to control | 2019 | Bioorganic & medicinal chemistry, 03-15, Volume: 27, Issue:6 ISSN: 1464-3391 | Design, synthesis and biological evaluation of inhibitors of cathepsin K on dedifferentiated chondrocytes. |
AID1512166 | Inhibition of Cathepsin L (unknown origin) using Z-Phe-Arg-7-amido-4-methylcoumarin as substrate preincubated for 2 mins followed by susbtrate addition by fluorescence based analysis | 2019 | Bioorganic & medicinal chemistry, 11-15, Volume: 27, Issue:22 ISSN: 1464-3391 | Synthesis and structure-activity relationship of nitrile-based cruzain inhibitors incorporating a trifluoroethylamine-based P2 amide replacement. |
AID314231 | Inhibition of cathepsin B in human HepG2 cells | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID314251 | Inhibition of antigen presenting mouse B cells | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID1572835 | Inhibition of MMP9 in mouse Primary chondrocytes derived after 2 passages at 1 uM after 24 hrs by Coomassie blue staining-based zymography assay | 2019 | Bioorganic & medicinal chemistry, 03-15, Volume: 27, Issue:6 ISSN: 1464-3391 | Design, synthesis and biological evaluation of inhibitors of cathepsin K on dedifferentiated chondrocytes. |
AID314247 | Oral bioavailability in rhesus monkey at 5 mg/kg | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID1918203 | Inhibition of Cathepsin K (unknown origin) assessed as inhibition of AFC release at 10 uM using sequence LR labelled with AFC as substrate by fluorescence based analysis | 2022 | Bioorganic & medicinal chemistry, Nov-15, Volume: 74ISSN: 1464-3391 | Discovery of selective covalent cathepsin K inhibitors containing novel 4-cyanopyrimidine warhead based on quantum chemical calculations and binding mode analysis. |
AID314235 | Metabolic stability in rat hepatocyte at 20 uM after 2 hrs assessed as recovery of parent compound | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID482898 | Selectivity for cathepsin K over cathepsin B | 2010 | Journal of medicinal chemistry, Jun-10, Volume: 53, Issue:11 ISSN: 1520-4804 | Emerging targets in osteoporosis disease modification. |
AID1918206 | Selectivity index, ratio of IC50 for Cathepsin S (unknown origin) to IC50 for Cathepsin K (unknown origin) by fluorescence based analysis | 2022 | Bioorganic & medicinal chemistry, Nov-15, Volume: 74ISSN: 1464-3391 | Discovery of selective covalent cathepsin K inhibitors containing novel 4-cyanopyrimidine warhead based on quantum chemical calculations and binding mode analysis. |
AID1512165 | Inhibition of Trypanosoma cruzi cruzain using Z-Phe-Arg-7-amido-4-methylcoumarin as substrate preincubated for 2 mins followed by susbtrate addition by fluorescence based analysis | 2019 | Bioorganic & medicinal chemistry, 11-15, Volume: 27, Issue:22 ISSN: 1464-3391 | Synthesis and structure-activity relationship of nitrile-based cruzain inhibitors incorporating a trifluoroethylamine-based P2 amide replacement. |
AID314243 | Oral bioavailability in dog at 5 mg/kg | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID314232 | Inhibition of cathepsin L in human HepG2 cells | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID482442 | Bioavailability in rat | 2010 | Journal of medicinal chemistry, Jun-10, Volume: 53, Issue:11 ISSN: 1520-4804 | Emerging targets in osteoporosis disease modification. |
AID482900 | Selectivity for cathepsin K over cathepsin S | 2010 | Journal of medicinal chemistry, Jun-10, Volume: 53, Issue:11 ISSN: 1520-4804 | Emerging targets in osteoporosis disease modification. |
AID1402856 | Inhibition of human cathepsin K | 2018 | European journal of medicinal chemistry, Jan-20, Volume: 144ISSN: 1768-3254 | Substrate-derived triazolo- and azapeptides as inhibitors of cathepsins K and S. |
AID569571 | Oral bioavailability in rat at 2 mg/kg, iv | 2011 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 21, Issue:3 ISSN: 1464-3405 | Difluoroethylamines as an amide isostere in inhibitors of cathepsin K. |
AID314241 | Half life in rat at 10 mg/kg, po | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID314244 | Clearance in dog at 5 mg/kg, po | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID314245 | Half life in dog at 5 mg/kg, po | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID314229 | Inhibition of rabbit cathepsin K | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID314230 | Inhibition of bone resorption in rabbit osteoclast | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID458225 | Selectivity ratio of IC50 for human cathepsin F to IC50 for humanized rabbit cathepsin K | 2010 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 20, Issue:3 ISSN: 1464-3405 | The discovery of MK-0674, an orally bioavailable cathepsin K inhibitor. |
AID569580 | Ratio of product of IC50 for rabbit bone resorption and IC50 for humanized rabbit cathepsin K to IC50 for rabbit cathepsin K | 2011 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 21, Issue:3 ISSN: 1464-3405 | Difluoroethylamines as an amide isostere in inhibitors of cathepsin K. |
AID314222 | Inhibition of cathepsin S | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID314252 | Inhibition of MHC 2 invariant chain iip10 in mouse splenocytes | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID458227 | Selectivity ratio of IC50 for human cathepsin S to IC50 for humanized rabbit cathepsin K | 2010 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 20, Issue:3 ISSN: 1464-3405 | The discovery of MK-0674, an orally bioavailable cathepsin K inhibitor. |
AID314228 | Inhibition of human cathepsin K | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID314236 | Metabolic stability in rhesus monkey hepatocyte at 20 uM after 2 hrs assessed as recovery of parent compound | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID482421 | Selectivity for cathepsin K over cathepsin V | 2010 | Journal of medicinal chemistry, Jun-10, Volume: 53, Issue:11 ISSN: 1520-4804 | Emerging targets in osteoporosis disease modification. |
AID458223 | Inhibition of humanized rabbit cathepsin K | 2010 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 20, Issue:3 ISSN: 1464-3405 | The discovery of MK-0674, an orally bioavailable cathepsin K inhibitor. |
AID458226 | Selectivity ratio of IC50 for human cathepsin L to IC50 for humanized rabbit cathepsin K | 2010 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 20, Issue:3 ISSN: 1464-3405 | The discovery of MK-0674, an orally bioavailable cathepsin K inhibitor. |
AID482422 | Selectivity for cathepsin K over cathepsin H | 2010 | Journal of medicinal chemistry, Jun-10, Volume: 53, Issue:11 ISSN: 1520-4804 | Emerging targets in osteoporosis disease modification. |
AID314227 | Inhibition of cathepsin Z | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID314240 | Clearance in rat at 10 mg/kg, po | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID569575 | Inhibition of humanized rabbit cathepsin K | 2011 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 21, Issue:3 ISSN: 1464-3405 | Difluoroethylamines as an amide isostere in inhibitors of cathepsin K. |
AID367446 | Metabolic stability in human hepatocytes assessed as compound remaining after 2 hrs | 2009 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 19, Issue:3 ISSN: 1464-3405 | Investigation of ketone warheads as alternatives to the nitrile for preparation of potent and selective cathepsin K inhibitors. |
AID1918205 | Inhibition of Cathepsin B (unknown origin) assessed as inhibition of AFC release using sequence RR labelled with AFC as substrate by fluorescence based analysis | 2022 | Bioorganic & medicinal chemistry, Nov-15, Volume: 74ISSN: 1464-3391 | Discovery of selective covalent cathepsin K inhibitors containing novel 4-cyanopyrimidine warhead based on quantum chemical calculations and binding mode analysis. |
AID1512167 | Lipophilicity, log Kw of compound by HPLC analysis | 2019 | Bioorganic & medicinal chemistry, 11-15, Volume: 27, Issue:22 ISSN: 1464-3391 | Synthesis and structure-activity relationship of nitrile-based cruzain inhibitors incorporating a trifluoroethylamine-based P2 amide replacement. |
AID314246 | Volume of distribution at steady state in dog at 5 mg/kg, po | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID569579 | Selectivity ratio of IC50 for human cathepsin S to IC50 for human cathepsin K | 2011 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 21, Issue:3 ISSN: 1464-3405 | Difluoroethylamines as an amide isostere in inhibitors of cathepsin K. |
AID1918204 | Inhibition of Cathepsin S (unknown origin) assessed as inhibition of AFC release using sequence VVR labelled with AFC as substrate by fluorescence based analysis | 2022 | Bioorganic & medicinal chemistry, Nov-15, Volume: 74ISSN: 1464-3391 | Discovery of selective covalent cathepsin K inhibitors containing novel 4-cyanopyrimidine warhead based on quantum chemical calculations and binding mode analysis. |
AID314226 | Inhibition of cathepsin H | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID482441 | Bioavailability in dog | 2010 | Journal of medicinal chemistry, Jun-10, Volume: 53, Issue:11 ISSN: 1520-4804 | Emerging targets in osteoporosis disease modification. |
AID569578 | Selectivity ratio of IC50 for human cathepsin L to IC50 for human cathepsin K | 2011 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 21, Issue:3 ISSN: 1464-3405 | Difluoroethylamines as an amide isostere in inhibitors of cathepsin K. |
AID314238 | Metabolic stability in dog hepatocyte at 20 uM after 2 hrs assessed as recovery of parent compound | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID314248 | Clearance in rhesus monkey at 5 mg/kg, po | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID367442 | Selectivity ratio of IC50 for human cathepsin B to IC50 for humanized rabbit cathepsin K | 2009 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 19, Issue:3 ISSN: 1464-3405 | Investigation of ketone warheads as alternatives to the nitrile for preparation of potent and selective cathepsin K inhibitors. |
AID314249 | Half life in rhesus monkey at 5 mg/kg, po | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID569572 | Half life in rat at 10 mg/kg, po or 2 mg/kg, iv | 2011 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 21, Issue:3 ISSN: 1464-3405 | Difluoroethylamines as an amide isostere in inhibitors of cathepsin K. |
AID1745854 | NCATS anti-infectives library activity on HEK293 viability as a counter-qHTS vs the C. elegans viability qHTS | 2023 | Disease models & mechanisms, 03-01, Volume: 16, Issue:3 ISSN: 1754-8411 | In vivo quantitative high-throughput screening for drug discovery and comparative toxicology. |
AID1745855 | NCATS anti-infectives library activity on the primary C. elegans qHTS viability assay | 2023 | Disease models & mechanisms, 03-01, Volume: 16, Issue:3 ISSN: 1754-8411 | In vivo quantitative high-throughput screening for drug discovery and comparative toxicology. |
AID1347411 | qHTS to identify inhibitors of the type 1 interferon - major histocompatibility complex class I in skeletal muscle: primary screen against the NCATS Mechanism Interrogation Plate v5.0 (MIPE) Libary | 2020 | ACS chemical biology, 07-17, Volume: 15, Issue:7 ISSN: 1554-8937 | High-Throughput Screening to Identify Inhibitors of the Type I Interferon-Major Histocompatibility Complex Class I Pathway in Skeletal Muscle. |
AID1345903 | Human cathepsin K (C1: Papain) | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
AID1345894 | Human cathepsin Z (C1: Papain) | 2008 | Bioorganic & medicinal chemistry letters, Feb-01, Volume: 18, Issue:3 ISSN: 1464-3405 | The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K. |
Research
Studies (147)
Timeframe | Studies, This Drug (%) | All Drugs % |
pre-1990 | 0 (0.00) | 18.7374 |
1990's | 0 (0.00) | 18.2507 |
2000's | 10 (6.80) | 29.6817 |
2010's | 115 (78.23) | 24.3611 |
2020's | 22 (14.97) | 2.80 |
Study Types
Publication Type | This drug (%) | All Drugs (%) |
Trials | 27 (18.24%) | 5.53% |
Reviews | 38 (25.68%) | 6.00% |
Case Studies | 1 (0.68%) | 4.05% |
Observational | 0 (0.00%) | 0.25% |
Other | 82 (55.41%) | 84.16% |
Substance | Studies | Classes | Roles | First Year | Last Year | Average Age | Relationship Strength | Trials | pre-1990 | 1990's | 2000's | 2010's | post-2020 |
aminolevulinic acid | | 4-oxo monocarboxylic acid; amino acid zwitterion; delta-amino acid | antineoplastic agent; dermatologic drug; Escherichia coli metabolite; human metabolite; mouse metabolite; photosensitizing agent; plant metabolite; prodrug; Saccharomyces cerevisiae metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
coumarin | | coumarins | fluorescent dye; human metabolite; plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
salicylic acid | | monohydroxybenzoic acid | algal metabolite; antifungal agent; antiinfective agent; EC 1.11.1.11 (L-ascorbate peroxidase) inhibitor; keratolytic drug; plant hormone; plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
thioctic acid | | dithiolanes; heterocyclic fatty acid; thia fatty acid | fundamental metabolite; geroprotector | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
picolinic acid | | pyridinemonocarboxylic acid | human metabolite; MALDI matrix material | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
thiamine | | primary alcohol; vitamin B1 | Escherichia coli metabolite; human metabolite; mouse metabolite; Saccharomyces cerevisiae metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
3-aminobenzamide | | benzamides; substituted aniline | EC 2.4.2.30 (NAD(+) ADP-ribosyltransferase) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
pleconaril | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
4-(2-aminoethyl)benzenesulfonylfluoride | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
phenytoin | | imidazolidine-2,4-dione | anticonvulsant; drug allergen; sodium channel blocker; teratogenic agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
acetazolamide | | monocarboxylic acid amide; sulfonamide; thiadiazoles | anticonvulsant; diuretic; EC 4.2.1.1 (carbonic anhydrase) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
alprenolol | | secondary alcohol; secondary amino compound | anti-arrhythmia drug; antihypertensive agent; beta-adrenergic antagonist; sympatholytic agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
am 251 | | amidopiperidine; carbohydrazide; dichlorobenzene; organoiodine compound; pyrazoles | antidepressant; antineoplastic agent; apoptosis inducer; CB1 receptor antagonist | 2010 | 2010 | 14.0 | low | 0 | 0 | 0 | 1 | 0 | 0 |
amantadine | | adamantanes; primary aliphatic amine | analgesic; antiparkinson drug; antiviral drug; dopaminergic agent; NMDA receptor antagonist; non-narcotic analgesic | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
2-aminothiazole | | 1,3-thiazoles; primary amino compound | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
amodiaquine | | aminoquinoline; organochlorine compound; phenols; secondary amino compound; tertiary amino compound | anticoronaviral agent; antimalarial; drug allergen; EC 2.1.1.8 (histamine N-methyltransferase) inhibitor; non-steroidal anti-inflammatory drug; prodrug | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
aspirin | | benzoic acids; phenyl acetates; salicylates | anticoagulant; antipyretic; cyclooxygenase 1 inhibitor; cyclooxygenase 2 inhibitor; drug allergen; EC 1.1.1.188 (prostaglandin-F synthase) inhibitor; geroprotector; non-narcotic analgesic; non-steroidal anti-inflammatory drug; plant activator; platelet aggregation inhibitor; prostaglandin antagonist; teratogenic agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
baclofen | | amino acid zwitterion; gamma-amino acid; monocarboxylic acid; monochlorobenzenes; primary amino compound | central nervous system depressant; GABA agonist; muscle relaxant | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
benzamide | | benzamides | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
camostat | | benzoate ester; carboxylic ester; diester; guanidines; tertiary carboxamide | anti-inflammatory agent; anticoronaviral agent; antifibrinolytic drug; antihypertensive agent; antineoplastic agent; antiviral agent; serine protease inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
camphor, (+-)-isomer | | bornane monoterpenoid; cyclic monoterpene ketone | plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
candesartan | | benzimidazolecarboxylic acid; biphenylyltetrazole | angiotensin receptor antagonist; antihypertensive agent; environmental contaminant; xenobiotic | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
cetylpyridinium | | pyridinium ion | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
chloroxylenol | | monochlorobenzenes; phenols | antiseptic drug; disinfectant; molluscicide | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
chlorpromazine | | organochlorine compound; phenothiazines; tertiary amine | anticoronaviral agent; antiemetic; dopaminergic antagonist; EC 3.4.21.26 (prolyl oligopeptidase) inhibitor; phenothiazine antipsychotic drug | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
ciprofibrate | | cyclopropanes; monocarboxylic acid; organochlorine compound | antilipemic drug | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
clomipramine | | dibenzoazepine | anticoronaviral agent; antidepressant; EC 1.8.1.12 (trypanothione-disulfide reductase) inhibitor; serotonergic antagonist; serotonergic drug; serotonin uptake inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
danthron | | dihydroxyanthraquinone | apoptosis inducer; plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
deferiprone | | 4-pyridones | iron chelator; protective agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
dipyridamole | | piperidines; pyrimidopyrimidine; tertiary amino compound; tetrol | adenosine phosphodiesterase inhibitor; EC 3.5.4.4 (adenosine deaminase) inhibitor; platelet aggregation inhibitor; vasodilator agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
disulfiram | | organic disulfide; organosulfur acaricide | angiogenesis inhibitor; antineoplastic agent; apoptosis inducer; EC 1.2.1.3 [aldehyde dehydrogenase (NAD(+))] inhibitor; EC 3.1.1.1 (carboxylesterase) inhibitor; EC 3.1.1.8 (cholinesterase) inhibitor; EC 5.99.1.2 (DNA topoisomerase) inhibitor; ferroptosis inducer; fungicide; NF-kappaB inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
valproic acid | | branched-chain fatty acid; branched-chain saturated fatty acid | anticonvulsant; antimanic drug; EC 3.5.1.98 (histone deacetylase) inhibitor; GABA agent; neuroprotective agent; psychotropic drug; teratogenic agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
doxazosin | | aromatic amine; benzodioxine; monocarboxylic acid amide; N-acylpiperazine; N-arylpiperazine; quinazolines | alpha-adrenergic antagonist; antihyperplasia drug; antihypertensive agent; antineoplastic agent; vasodilator agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
ebselen | | benzoselenazole | anti-inflammatory drug; antibacterial agent; anticoronaviral agent; antifungal agent; antineoplastic agent; antioxidant; apoptosis inducer; EC 1.13.11.33 (arachidonate 15-lipoxygenase) inhibitor; EC 1.13.11.34 (arachidonate 5-lipoxygenase) inhibitor; EC 1.3.1.8 [acyl-CoA dehydrogenase (NADP(+))] inhibitor; EC 1.8.1.12 (trypanothione-disulfide reductase) inhibitor; EC 2.5.1.7 (UDP-N-acetylglucosamine 1-carboxyvinyltransferase) inhibitor; EC 2.7.10.1 (receptor protein-tyrosine kinase) inhibitor; EC 3.1.3.25 (inositol-phosphate phosphatase) inhibitor; EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor; EC 3.5.4.1 (cytosine deaminase) inhibitor; EC 5.1.3.2 (UDP-glucose 4-epimerase) inhibitor; enzyme mimic; ferroptosis inhibitor; genotoxin; hepatoprotective agent; neuroprotective agent; radical scavenger | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
etidronate | | 1,1-bis(phosphonic acid) | antineoplastic agent; bone density conservation agent; chelator | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
2-hexyloxybenzamide | | aromatic ether; benzamides | antifungal agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
brl 42810 | | 2-aminopurines; acetate ester | antiviral drug; prodrug | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
fluphenazine | | N-alkylpiperazine; organofluorine compound; phenothiazines | anticoronaviral agent; dopaminergic antagonist; phenothiazine antipsychotic drug | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
fluorouracil | | nucleobase analogue; organofluorine compound | antimetabolite; antineoplastic agent; environmental contaminant; immunosuppressive agent; radiosensitizing agent; xenobiotic | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
gabexate | | benzoate ester | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
glutaral | | dialdehyde | cross-linking reagent; disinfectant; fixative | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
fasudil | | isoquinolines; N-sulfonyldiazepane | antihypertensive agent; calcium channel blocker; EC 2.7.11.1 (non-specific serine/threonine protein kinase) inhibitor; geroprotector; neuroprotective agent; nootropic agent; vasodilator agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
haloperidol | | aromatic ketone; hydroxypiperidine; monochlorobenzenes; organofluorine compound; tertiary alcohol | antidyskinesia agent; antiemetic; dopaminergic antagonist; first generation antipsychotic; serotonergic antagonist | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
miltefosine | | phosphocholines; phospholipid | anti-inflammatory agent; anticoronaviral agent; antifungal agent; antineoplastic agent; antiprotozoal drug; apoptosis inducer; immunomodulator; protein kinase inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
hexylresorcinol | | resorcinols | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
beta-thujaplicin | | cyclic ketone; enol; monoterpenoid | antibacterial agent; antifungal agent; antineoplastic agent; antiplasmodial drug; plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
hycanthone | | thioxanthenes | mutagen; schistosomicide drug | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
hydrochlorothiazide | | benzothiadiazine; organochlorine compound; sulfonamide | antihypertensive agent; diuretic; environmental contaminant; xenobiotic | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
hydroxyurea | | one-carbon compound; ureas | antimetabolite; antimitotic; antineoplastic agent; DNA synthesis inhibitor; EC 1.17.4.1 (ribonucleoside-diphosphate reductase) inhibitor; genotoxin; immunomodulator; radical scavenger; teratogenic agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
ibuprofen | | monocarboxylic acid | antipyretic; cyclooxygenase 1 inhibitor; cyclooxygenase 2 inhibitor; drug allergen; environmental contaminant; geroprotector; non-narcotic analgesic; non-steroidal anti-inflammatory drug; radical scavenger; xenobiotic | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
indomethacin | | aromatic ether; indole-3-acetic acids; monochlorobenzenes; N-acylindole | analgesic; drug metabolite; EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor; environmental contaminant; gout suppressant; non-steroidal anti-inflammatory drug; xenobiotic metabolite; xenobiotic | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
avapro | | azaspiro compound; biphenylyltetrazole | angiotensin receptor antagonist; antihypertensive agent; environmental contaminant; xenobiotic | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
itraconazole | | piperazines | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
kojic acid | | 4-pyranones; enol; primary alcohol | Aspergillus metabolite; EC 1.10.3.1 (catechol oxidase) inhibitor; EC 1.10.3.2 (laccase) inhibitor; EC 1.13.11.24 (quercetin 2,3-dioxygenase) inhibitor; EC 1.14.18.1 (tyrosinase) inhibitor; EC 1.4.3.3 (D-amino-acid oxidase) inhibitor; NF-kappaB inhibitor; skin lightening agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
lapachol | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
loperamide | | monocarboxylic acid amide; monochlorobenzenes; piperidines; tertiary alcohol | anticoronaviral agent; antidiarrhoeal drug; mu-opioid receptor agonist | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
loratadine | | benzocycloheptapyridine; ethyl ester; N-acylpiperidine; organochlorine compound; tertiary carboxamide | anti-allergic agent; cholinergic antagonist; geroprotector; H1-receptor antagonist | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
losartan | | biphenylyltetrazole; imidazoles | angiotensin receptor antagonist; anti-arrhythmia drug; antihypertensive agent; endothelin receptor antagonist | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
4-(dimethylamino)-n-(7-(hydroxyamino)-7-oxoheptyl)benzamide | | benzamides; hydroxamic acid; secondary carboxamide; tertiary amino compound | antineoplastic agent; apoptosis inducer; EC 3.5.1.98 (histone deacetylase) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
mafenide | | aromatic amine | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
methazolamide | | sulfonamide; thiadiazoles | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
methocarbamol | | aromatic ether; carbamate ester; secondary alcohol | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
mitoxantrone | | dihydroxyanthraquinone | analgesic; antineoplastic agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
entinostat | | benzamides; carbamate ester; primary amino compound; pyridines; substituted aniline | antineoplastic agent; apoptosis inducer; EC 3.5.1.98 (histone deacetylase) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
ethylmaleimide | | maleimides | anticoronaviral agent; EC 1.3.1.8 [acyl-CoA dehydrogenase (NADP(+))] inhibitor; EC 2.1.1.122 [(S)-tetrahydroprotoberberine N-methyltransferase] inhibitor; EC 2.7.1.1 (hexokinase) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
nabumetone | | methoxynaphthalene; methyl ketone | cyclooxygenase 2 inhibitor; non-narcotic analgesic; non-steroidal anti-inflammatory drug; prodrug | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
nafamostat | | benzoic acids; guanidines | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
nevirapine | | cyclopropanes; dipyridodiazepine | antiviral drug; HIV-1 reverse transcriptase inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
omeprazole | | aromatic ether; benzimidazoles; pyridines; sulfoxide | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
osalmide | | organic molecular entity | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
oxethazaine | | amino acid amide | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
palmidrol | | endocannabinoid; N-(long-chain-acyl)ethanolamine; N-(saturated fatty acyl)ethanolamine | anti-inflammatory drug; anticonvulsant; antihypertensive agent; neuroprotective agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
papaverine | | benzylisoquinoline alkaloid; dimethoxybenzene; isoquinolines | antispasmodic drug; vasodilator agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
pentoxifylline | | oxopurine | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
perhexiline | | piperidines | cardiovascular drug | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
phenazopyridine | | diaminopyridine; monoazo compound | anticoronaviral agent; carcinogenic agent; local anaesthetic; non-narcotic analgesic | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
4-phenylbutyric acid | | monocarboxylic acid | antineoplastic agent; apoptosis inducer; EC 3.5.1.98 (histone deacetylase) inhibitor; prodrug | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
phenylmethylsulfonyl fluoride | | acyl fluoride | serine proteinase inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
pimobendan | | benzimidazoles; pyridazinone | cardiotonic drug; EC 3.1.4.* (phosphoric diester hydrolase) inhibitor; vasodilator agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
pj-34 | | phenanthridines; secondary carboxamide; tertiary amino compound | angiogenesis inhibitor; anti-inflammatory agent; antiatherosclerotic agent; antineoplastic agent; apoptosis inducer; cardioprotective agent; EC 2.4.2.30 (NAD(+) ADP-ribosyltransferase) inhibitor; neuroprotective agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
praziquantel | | isoquinolines | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
probenecid | | benzoic acids; sulfonamide | uricosuric drug | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
probucol | | dithioketal; polyphenol | anti-inflammatory drug; anticholesteremic drug; antilipemic drug; antioxidant; cardiovascular drug | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
promazine | | phenothiazines; tertiary amine | antiemetic; dopaminergic antagonist; EC 3.4.21.26 (prolyl oligopeptidase) inhibitor; H1-receptor antagonist; muscarinic antagonist; phenothiazine antipsychotic drug; serotonergic antagonist | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
promethazine | | phenothiazines; tertiary amine | anti-allergic agent; anticoronaviral agent; antiemetic; antipruritic drug; H1-receptor antagonist; local anaesthetic; sedative | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
propranolol | | naphthalenes; propanolamine; secondary amine | anti-arrhythmia drug; antihypertensive agent; anxiolytic drug; beta-adrenergic antagonist; environmental contaminant; human blood serum metabolite; vasodilator agent; xenobiotic | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
rimantadine | | alkylamine | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
rolipram | | pyrrolidin-2-ones | antidepressant; EC 3.1.4.* (phosphoric diester hydrolase) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
scriptaid | | isoquinolines | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
sebacic acid | | alpha,omega-dicarboxylic acid; dicarboxylic fatty acid | human metabolite; plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
fenofibrate | | benzochromenone; delta-lactone; naphtho-alpha-pyrone | platelet aggregation inhibitor; Sir2 inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
imatinib | | aromatic amine; benzamides; N-methylpiperazine; pyridines; pyrimidines | antineoplastic agent; apoptosis inducer; tyrosine kinase inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
suprofen | | aromatic ketone; monocarboxylic acid; thiophenes | antirheumatic drug; drug allergen; EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor; non-narcotic analgesic; non-steroidal anti-inflammatory drug; peripheral nervous system drug | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
thalidomide | | phthalimides; piperidones | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
ticlopidine | | monochlorobenzenes; thienopyridine | anticoagulant; fibrin modulating drug; hematologic agent; P2Y12 receptor antagonist; platelet aggregation inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
triamterene | | pteridines | diuretic; sodium channel blocker | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
trifluoperazine | | N-alkylpiperazine; N-methylpiperazine; organofluorine compound; phenothiazines | antiemetic; calmodulin antagonist; dopaminergic antagonist; EC 1.8.1.12 (trypanothione-disulfide reductase) inhibitor; EC 5.3.3.5 (cholestenol Delta-isomerase) inhibitor; phenothiazine antipsychotic drug | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
triflupromazine | | organofluorine compound; phenothiazines; tertiary amine | anticoronaviral agent; antiemetic; dopaminergic antagonist; first generation antipsychotic | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
trigonelline | | alkaloid; iminium betaine | food component; human urinary metabolite; plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
trimethobenzamide | | benzamides; tertiary amino compound | antiemetic | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
trimethoprim | | aminopyrimidine; methoxybenzenes | antibacterial drug; diuretic; drug allergen; EC 1.5.1.3 (dihydrofolate reductase) inhibitor; environmental contaminant; xenobiotic | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
tyrphostin a9 | | alkylbenzene | geroprotector | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
delavirdine | | aminopyridine; indolecarboxamide; N-acylpiperazine; sulfonamide | antiviral drug; HIV-1 reverse transcriptase inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
vesnarinone | | organic molecular entity | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
idoxuridine | | organoiodine compound; pyrimidine 2'-deoxyribonucleoside | antiviral drug; DNA synthesis inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
chloramphenicol | | C-nitro compound; carboxamide; diol; organochlorine compound | antibacterial drug; antimicrobial agent; Escherichia coli metabolite; geroprotector; Mycoplasma genitalium metabolite; protein synthesis inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
lysine | | aspartate family amino acid; L-alpha-amino acid zwitterion; L-alpha-amino acid; lysine; organic molecular entity; proteinogenic amino acid | algal metabolite; anticonvulsant; Escherichia coli metabolite; human metabolite; micronutrient; mouse metabolite; nutraceutical; plant metabolite; Saccharomyces cerevisiae metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
phenylethyl alcohol | | benzenes; primary alcohol | Aspergillus metabolite; fragrance; plant growth retardant; plant metabolite; Saccharomyces cerevisiae metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
zoxazolamine | | benzoxazole | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
cycloheximide | | antibiotic fungicide; cyclic ketone; dicarboximide; piperidine antibiotic; piperidones; secondary alcohol | anticoronaviral agent; bacterial metabolite; ferroptosis inhibitor; neuroprotective agent; protein synthesis inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
ficusin | | psoralens | plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
tubercidin | | antibiotic antifungal agent; N-glycosylpyrrolopyrimidine; ribonucleoside | antimetabolite; antineoplastic agent; bacterial metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
trifluridine | | nucleoside analogue; organofluorine compound; pyrimidine 2'-deoxyribonucleoside | antimetabolite; antineoplastic agent; antiviral drug; EC 2.1.1.45 (thymidylate synthase) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
9,10-anthraquinone | | anthraquinone | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
salicylanilide | | benzanilide fungicide; salicylamides; salicylanilides | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
gramine | | aminoalkylindole; indole alkaloid; tertiary amino compound | antibacterial agent; antiviral agent; plant metabolite; serotonergic antagonist | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
aminacrine | | aminoacridines; primary amino compound | acid-base indicator; antiinfective agent; antiseptic drug; fluorescent dye; MALDI matrix material; mutagen | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
methyl gallate | | gallate ester | anti-inflammatory agent; antioxidant; plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
monobenzone | | benzyl ether | allergen; dermatologic drug; melanin synthesis inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
ditiocarb | | dithiocarbamic acids | chelator; copper chelator | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
catechin | | catechin | antioxidant; plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
azacitidine | | N-glycosyl-1,3,5-triazine; nucleoside analogue | antineoplastic agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
lucanthone | | thioxanthenes | adjuvant; antineoplastic agent; EC 5.99.1.2 (DNA topoisomerase) inhibitor; EC 5.99.1.3 [DNA topoisomerase (ATP-hydrolysing)] inhibitor; mutagen; photosensitizing agent; prodrug; schistosomicide drug | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
cepharanthine | | bisbenzylisoquinoline alkaloid; isoquinolines | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
aloe emodin | | aromatic primary alcohol; dihydroxyanthraquinone | antineoplastic agent; plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
chrysophanic acid | | dihydroxyanthraquinone | anti-inflammatory agent; antiviral agent; plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
emetine | | isoquinoline alkaloid; pyridoisoquinoline | antiamoebic agent; anticoronaviral agent; antiinfective agent; antimalarial; antineoplastic agent; antiprotozoal drug; antiviral agent; autophagy inhibitor; emetic; expectorant; plant metabolite; protein synthesis inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
osthol | | botanical anti-fungal agent; coumarins | metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
flavanone | | flavanones | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
phloretic acid | | hydroxy monocarboxylic acid | plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
oleanolic acid | | hydroxy monocarboxylic acid; pentacyclic triterpenoid | plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
angelicin | | furanocoumarin | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
diperodon | | carbamate ester | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
megestrol acetate | | 20-oxo steroid; 3-oxo-Delta(4) steroid; acetate ester; steroid ester | antineoplastic agent; appetite enhancer; contraceptive drug; progestin; synthetic oral contraceptive | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
acetylcysteine | | acetylcysteine; L-cysteine derivative; N-acetyl-L-amino acid | antidote to paracetamol poisoning; antiinfective agent; antioxidant; antiviral drug; ferroptosis inhibitor; geroprotector; human metabolite; mucolytic; radical scavenger; vulnerary | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
hydroxychloroquine sulfate | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
ethambutol | | ethanolamines; ethylenediamine derivative | antitubercular agent; environmental contaminant; xenobiotic | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
metformin hydrochloride | | hydrochloride | environmental contaminant; hypoglycemic agent; xenobiotic | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
antimycin a | | benzamides; formamides; macrodiolide; phenols | antifungal agent; mitochondrial respiratory-chain inhibitor; piscicide | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
5,5'-dimethyl-2,2'-bipyridyl | | bipyridines | | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
dichlorobenzyl alcohol | | benzyl alcohols; dichlorobenzene | antiseptic drug | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
stavudine | | dihydrofuran; nucleoside analogue; organic molecular entity | antimetabolite; antiviral agent; EC 2.7.7.49 (RNA-directed DNA polymerase) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
dideoxyadenosine | | adenosines; purine 2',3'-dideoxyribonucleoside | EC 3.5.4.4 (adenosine deaminase) inhibitor; EC 4.6.1.1 (adenylate cyclase) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
vidarabine | | beta-D-arabinoside; purine nucleoside | antineoplastic agent; bacterial metabolite; nucleoside antibiotic | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
3-deazaadenosine | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
zalcitabine | | pyrimidine 2',3'-dideoxyribonucleoside | antimetabolite; antiviral drug; HIV-1 reverse transcriptase inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
ancitabine | | diol; organic heterotricyclic compound | antimetabolite; antineoplastic agent; prodrug | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
chloropyramine | | aminopyridine | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
levamisole | | 6-phenyl-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole | antinematodal drug; antirheumatic drug; EC 3.1.3.1 (alkaline phosphatase) inhibitor; immunological adjuvant; immunomodulator | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
n'-nitrosonornicotine | | pyridines; pyrrolidines | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
daunorubicin | | aminoglycoside antibiotic; anthracycline; p-quinones; tetracenequinones | antineoplastic agent; bacterial metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
zidovudine | | azide; pyrimidine 2',3'-dideoxyribonucleoside | antimetabolite; antiviral drug; HIV-1 reverse transcriptase inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
ribavirin | | 1-ribosyltriazole; aromatic amide; monocarboxylic acid amide; primary carboxamide | anticoronaviral agent; antiinfective agent; antimetabolite; antiviral agent; EC 2.7.7.49 (RNA-directed DNA polymerase) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
pyridoxal phosphate | | pyridinecarbaldehyde | | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
nitazoxanide | | benzamides; carboxylic ester | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
captopril | | alkanethiol; L-proline derivative; N-acylpyrrolidine; pyrrolidinemonocarboxylic acid | antihypertensive agent; EC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
oltipraz | | 1,2-dithiole; pyrazines | angiogenesis modulating agent; antimutagen; antineoplastic agent; antioxidant; EC 3.1.3.48 (protein-tyrosine-phosphatase) inhibitor; neurotoxin; protective agent; schistosomicide drug | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
fiacitabine | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
ranolazine | | aromatic amide; monocarboxylic acid amide; monomethoxybenzene; N-alkylpiperazine; secondary alcohol | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
brequinar | | biphenyls; monocarboxylic acid; monofluorobenzenes; quinolinemonocarboxylic acid | anticoronaviral agent; antimetabolite; antineoplastic agent; antiviral agent; EC 1.3.5.2 [dihydroorotate dehydrogenase (quinone)] inhibitor; immunosuppressive agent; pyrimidine synthesis inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
imiquimod | | imidazoquinoline | antineoplastic agent; interferon inducer | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
adefovir | | 6-aminopurines; ether; phosphonic acids | antiviral drug; DNA synthesis inhibitor; drug metabolite; HIV-1 reverse transcriptase inhibitor; nephrotoxic agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
cidofovir anhydrous | | phosphonic acids; pyrimidone | anti-HIV agent; antineoplastic agent; antiviral drug; photosensitizing agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
celgosivir | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
gemcitabine | | organofluorine compound; pyrimidine 2'-deoxyribonucleoside | antimetabolite; antineoplastic agent; antiviral drug; DNA synthesis inhibitor; EC 1.17.4.1 (ribonucleoside-diphosphate reductase) inhibitor; environmental contaminant; immunosuppressive agent; photosensitizing agent; prodrug; radiosensitizing agent; xenobiotic | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
lamivudine | | monothioacetal; nucleoside analogue; oxacycle; primary alcohol | allergen; anti-HBV agent; antiviral drug; EC 2.7.7.49 (RNA-directed DNA polymerase) inhibitor; HIV-1 reverse transcriptase inhibitor; prodrug | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
valsartan | | biphenylyltetrazole; monocarboxylic acid amide; monocarboxylic acid | angiotensin receptor antagonist; antihypertensive agent; environmental contaminant; xenobiotic | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
zanamivir | | guanidines | antiviral agent; EC 3.2.1.18 (exo-alpha-sialidase) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
adefovir dipivoxil | | 6-aminopurines; carbonate ester; ether; organic phosphonate | antiviral drug; DNA synthesis inhibitor; HIV-1 reverse transcriptase inhibitor; nephrotoxic agent; prodrug | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
emtricitabine | | monothioacetal; nucleoside analogue; organofluorine compound; pyrimidone | antiviral drug; HIV-1 reverse transcriptase inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
octyl gallate | | gallate ester | food antioxidant; hypoglycemic agent; plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
efavirenz | | acetylenic compound; benzoxazine; cyclopropanes; organochlorine compound; organofluorine compound | antiviral drug; HIV-1 reverse transcriptase inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
nelfinavir | | aryl sulfide; benzamides; organic heterobicyclic compound; phenols; secondary alcohol; tertiary amino compound | antineoplastic agent; HIV protease inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
betulinic acid | | hydroxy monocarboxylic acid; pentacyclic triterpenoid | anti-HIV agent; anti-inflammatory agent; antimalarial; antineoplastic agent; EC 5.99.1.3 [DNA topoisomerase (ATP-hydrolysing)] inhibitor; plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
arctigenin | | lignan | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
baicalin | | dihydroxyflavone; glucosiduronic acid; glycosyloxyflavone; monosaccharide derivative | antiatherosclerotic agent; antibacterial agent; anticoronaviral agent; antineoplastic agent; antioxidant; cardioprotective agent; EC 2.7.7.48 (RNA-directed RNA polymerase) inhibitor; EC 3.4.21.26 (prolyl oligopeptidase) inhibitor; ferroptosis inhibitor; neuroprotective agent; non-steroidal anti-inflammatory drug; plant metabolite; prodrug | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
plerixafor | | azacycloalkane; azamacrocycle; benzenes; crown amine; secondary amino compound; tertiary amino compound | anti-HIV agent; antineoplastic agent; C-X-C chemokine receptor type 4 antagonist; immunological adjuvant | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
amprenavir | | carbamate ester; sulfonamide; tetrahydrofuryl ester | antiviral drug; HIV protease inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
oseltamivir | | acetamides; amino acid ester; cyclohexenecarboxylate ester; primary amino compound | antiviral drug; EC 3.2.1.18 (exo-alpha-sialidase) inhibitor; environmental contaminant; prodrug; xenobiotic | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
epigallocatechin gallate | | flavans; gallate ester; polyphenol | antineoplastic agent; antioxidant; apoptosis inducer; geroprotector; Hsp90 inhibitor; neuroprotective agent; plant metabolite | 2010 | 2023 | 7.5 | low | 0 | 0 | 0 | 1 | 0 | 1 |
1,2,3,4,6-pentakis-O-galloyl-beta-D-glucose | | gallate ester; galloyl beta-D-glucose | anti-inflammatory agent; antineoplastic agent; geroprotector; hepatoprotective agent; plant metabolite; radiation protective agent; radical scavenger | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
cephalotaxine | | benzazepine alkaloid fundamental parent; benzazepine alkaloid; cyclic acetal; enol ether; organic heteropentacyclic compound; secondary alcohol; tertiary amino compound | | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
desipramine hydrochloride | | hydrochloride | drug allergen | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
mefloquine hydrochloride | | hydrochloride | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
aloxistatin | | epoxide; ethyl ester; L-leucine derivative; monocarboxylic acid amide | anticoronaviral agent; cathepsin B inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
propazole | | benzimidazoles | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
prulifloxacin | | fluoroquinolone antibiotic; quinolone antibiotic | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
telmisartan | | benzimidazoles; biphenyls; carboxybiphenyl | angiotensin receptor antagonist; antihypertensive agent; EC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor; environmental contaminant; xenobiotic | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
bergenin | | trihydroxybenzoic acid | metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
zoledronic acid | | 1,1-bis(phosphonic acid); imidazoles | bone density conservation agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
artemisinin | | organic peroxide; sesquiterpene lactone | antimalarial; plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
brinzolamide | | sulfonamide; thienothiazine | antiglaucoma drug; EC 4.2.1.1 (carbonic anhydrase) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
dipropylacetamide | | fatty amide | geroprotector; metabolite; teratogenic agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
oxprenolol hydrochloride | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
opipramol hydrochloride | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
moroxydine | | biguanides | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
thioxolone | | benzoxathiole | antiseborrheic | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
honokiol | | biphenyls | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
nobiletin | | methoxyflavone | antineoplastic agent; plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
lycorine | | indolizidine alkaloid | anticoronaviral agent; antimalarial; plant metabolite; protein synthesis inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
leupeptin | | aldehyde; tripeptide | bacterial metabolite; calpain inhibitor; cathepsin B inhibitor; EC 3.4.21.4 (trypsin) inhibitor; serine protease inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
tetrandrine | | bisbenzylisoquinoline alkaloid; isoquinolines | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
calpeptin | | amino acid amide | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
fangchinoline | | aromatic ether; bisbenzylisoquinoline alkaloid; macrocycle | anti-HIV-1 agent; anti-inflammatory agent; antineoplastic agent; antioxidant; neuroprotective agent; plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
maslinic acid | | dihydroxy monocarboxylic acid; pentacyclic triterpenoid | anti-inflammatory agent; antineoplastic agent; antioxidant; plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
atovaquone | | hydroxy-1,2-naphthoquinone | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
loganin | | beta-D-glucoside; cyclopentapyran; enoate ester; iridoid monoterpenoid; methyl ester; monosaccharide derivative; secondary alcohol | anti-inflammatory agent; EC 3.1.1.7 (acetylcholinesterase) inhibitor; EC 3.2.1.20 (alpha-glucosidase) inhibitor; EC 3.4.23.46 (memapsin 2) inhibitor; neuroprotective agent; plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
moexipril | | peptide | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
aucubin | | organic molecular entity | metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
catalpol | | organic molecular entity | metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
lekoptin | | 2-(3,4-dimethoxyphenyl)-5-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-2-(propan-2-yl)pentanenitrile | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
n-methyladenosine | | methyladenosine | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
cp-55,940 | | | | 2010 | 2010 | 14.0 | low | 0 | 0 | 0 | 1 | 0 | 0 |
sivelestat | | N-acylglycine; pivalate ester | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
pyronaridine | | aminoquinoline | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
geniposide | | terpene glycoside | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
daidzin | | 7-hydroxyisoflavones 7-O-beta-D-glucoside; hydroxyisoflavone; monosaccharide derivative | plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
sophocarpine | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
marimastat | | hydroxamic acid; secondary carboxamide | antineoplastic agent; matrix metalloproteinase inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
elacridar | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
celastrol | | monocarboxylic acid; pentacyclic triterpenoid | anti-inflammatory drug; antineoplastic agent; antioxidant; EC 5.99.1.3 [DNA topoisomerase (ATP-hydrolysing)] inhibitor; Hsp90 inhibitor; metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
n-(n-(3-carboxyoxirane-2-carbonyl)leucyl)isoamylamine | | leucine derivative | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
vadimezan | | monocarboxylic acid; xanthones | antineoplastic agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
e 64 | | dicarboxylic acid monoamide; epoxy monocarboxylic acid; guanidines; L-leucine derivative; zwitterion | antimalarial; antiparasitic agent; protease inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
umifenovir | | indolyl carboxylic acid | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
safinamide | | amino acid amide | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
ilomastat | | hydroxamic acid; L-tryptophan derivative; N-acyl-amino acid | anti-inflammatory agent; antibacterial agent; antineoplastic agent; EC 3.4.24.24 (gelatinase A) inhibitor; neuroprotective agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
atazanavir | | carbohydrazide | antiviral drug; HIV protease inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
vx 497 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
bcx 1812 | | 3-hydroxy monocarboxylic acid; acetamides; cyclopentanols; guanidines | antiviral drug; EC 3.2.1.18 (exo-alpha-sialidase) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
naproxen | | methoxynaphthalene; monocarboxylic acid | antipyretic; cyclooxygenase 1 inhibitor; cyclooxygenase 2 inhibitor; drug allergen; environmental contaminant; gout suppressant; non-narcotic analgesic; non-steroidal anti-inflammatory drug; xenobiotic | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
olmesartan | | biphenylyltetrazole | angiotensin receptor antagonist; antihypertensive agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
telbivudine | | pyrimidine 2'-deoxyribonucleoside | antiviral drug; EC 2.7.7.49 (RNA-directed DNA polymerase) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
celastrol methyl ester | | carboxylic ester | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
resiquimod | | imidazoquinoline | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
tanshinone ii a | | abietane diterpenoid | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
anacardic acid | | hydroxy monocarboxylic acid; hydroxybenzoic acid | anti-inflammatory agent; antibacterial agent; anticoronaviral agent; apoptosis inducer; EC 2.3.1.48 (histone acetyltransferase) inhibitor; EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor; neuroprotective agent; plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
migalastat | | piperidines | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
erlotinib | | aromatic ether; quinazolines; secondary amino compound; terminal acetylenic compound | antineoplastic agent; epidermal growth factor receptor antagonist; protein kinase inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
cilengitide | | oligopeptide | | 2010 | 2010 | 14.0 | low | 0 | 0 | 0 | 1 | 0 | 0 |
limonin | | epoxide; furans; hexacyclic triterpenoid; lactone; limonoid; organic heterohexacyclic compound | inhibitor; metabolite; volatile oil component | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
scutellarin | | glucosiduronic acid; glycosyloxyflavone; monosaccharide derivative; trihydroxyflavone | antineoplastic agent; proteasome inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
etravirine | | aminopyrimidine; aromatic ether; dinitrile; organobromine compound | antiviral agent; HIV-1 reverse transcriptase inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
chelidonine | | alkaloid antibiotic; alkaloid fundamental parent; benzophenanthridine alkaloid | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
4-n-butylresorcinol | | resorcinols | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
darunavir | | carbamate ester; furofuran; sulfonamide | antiviral drug; HIV protease inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
dapivirine | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
nsc 74859 | | amidobenzoic acid; monohydroxybenzoic acid; tosylate ester | STAT3 inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
berbamine | | bisbenzylisoquinoline alkaloid; isoquinolines | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
u-104 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
7-hydroxy-5-methyl-2-(2-oxopropyl)-8-[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]-1-benzopyran-4-one | | glycoside | | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
bortezomib | | amino acid amide; L-phenylalanine derivative; pyrazines | antineoplastic agent; antiprotozoal drug; protease inhibitor; proteasome inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
ritonavir | | 1,3-thiazoles; carbamate ester; carboxamide; L-valine derivative; ureas | antiviral drug; environmental contaminant; HIV protease inhibitor; xenobiotic | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
tizoxanide | | salicylamides | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
arbutin | | beta-D-glucoside; monosaccharide derivative | Escherichia coli metabolite; plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
quinidine | | cinchona alkaloid | alpha-adrenergic antagonist; anti-arrhythmia drug; antimalarial; drug allergen; EC 1.14.13.181 (13-deoxydaunorubicin hydroxylase) inhibitor; EC 3.6.3.44 (xenobiotic-transporting ATPase) inhibitor; muscarinic antagonist; P450 inhibitor; potassium channel blocker; sodium channel blocker | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
conessine | | steroid alkaloid; tertiary amino compound | antibacterial agent; antimalarial; H3-receptor antagonist; plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
saquinavir | | L-asparagine derivative; quinolines | antiviral drug; HIV protease inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
abacavir | | 2,6-diaminopurines | antiviral drug; drug allergen; HIV-1 reverse transcriptase inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
linezolid | | acetamides; morpholines; organofluorine compound; oxazolidinone | antibacterial drug; protein synthesis inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
cephaelin | | pyridoisoquinoline | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
naringin | | (2S)-flavan-4-one; 4'-hydroxyflavanones; dihydroxyflavanone; disaccharide derivative; neohesperidoside | anti-inflammatory agent; antineoplastic agent; metabolite | 2010 | 2010 | 14.0 | low | 0 | 0 | 0 | 1 | 0 | 0 |
(-)-usnic acid | | usnic acid | EC 1.13.11.27 (4-hydroxyphenylpyruvate dioxygenase) inhibitor | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
acetylleucyl-leucyl-norleucinal | | aldehyde; tripeptide | cysteine protease inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
resveratrol | | resveratrol | antioxidant; phytoalexin; plant metabolite; quorum sensing inhibitor; radical scavenger | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
tacrolimus | | macrolide lactam | bacterial metabolite; immunosuppressive agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
lycopene | | acyclic carotene | antioxidant; plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
zithromax | | macrolide antibiotic | antibacterial drug; environmental contaminant; xenobiotic | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
roflumilast | | aromatic ether; benzamides; chloropyridine; cyclopropanes; organofluorine compound | anti-asthmatic drug; phosphodiesterase IV inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
L-cycloserine | | 4-amino-1,2-oxazolidin-3-one | anti-HIV agent; anticonvulsant; EC 2.3.1.50 (serine C-palmitoyltransferase) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
h 89 | | N-[2-(4-bromocinnamylamino)ethyl]isoquinoline-5-sulfonamide | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
bevirimat | | dicarboxylic acid monoester; monocarboxylic acid; pentacyclic triterpenoid | HIV-1 maturation inhibitor; metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
benzyloxycarbonylleucyl-leucyl-leucine aldehyde | | amino aldehyde; carbamate ester; tripeptide | proteasome inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
tenofovir | | nucleoside analogue; phosphonic acids | antiviral drug; drug metabolite; HIV-1 reverse transcriptase inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
posaconazole | | aromatic ether; conazole antifungal drug; N-arylpiperazine; organofluorine compound; oxolanes; triazole antifungal drug; triazoles | trypanocidal drug | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
gw 257406x | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
shikonin | | hydroxy-1,4-naphthoquinone | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
4,4-difluoro-N-[(1S)-3-[3-(3-methyl-5-propan-2-yl-1,2,4-triazol-4-yl)-8-azabicyclo[3.2.1]octan-8-yl]-1-phenylpropyl]-1-cyclohexanecarboxamide | | tropane alkaloid | | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
cmx 001 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
amd 8664 | | | | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
bay 41-4109 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
bay 57-1293 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
2'-c-methylcytidine | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
isoxanthohumol | | flavanones | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
4-(4-chloro-2-methylphenoxy)-n-hydroxybutanamide | | aromatic ether | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
mecarbinate | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
cannabidiol | | olefinic compound; phytocannabinoid; resorcinols | antimicrobial agent; plant metabolite | 2010 | 2010 | 14.0 | low | 0 | 0 | 0 | 1 | 0 | 0 |
acetyl-aspartyl-glutamyl-valyl-aspartal | | tetrapeptide | protease inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
octotropine methylbromide | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
mercaptopurine | | aryl thiol; purines; thiocarbonyl compound | anticoronaviral agent; antimetabolite; antineoplastic agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
jrf 12 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
3,4'-dihydroxyflavone | | | | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
3-(3,4-dimethoxyphenyl)propenoic acid | | methoxycinnamic acid | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
isoferulic acid | | ferulic acids | antioxidant; biomarker; metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
cyclouridine | | | | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
curcumin | | aromatic ether; beta-diketone; diarylheptanoid; enone; polyphenol | anti-inflammatory agent; antifungal agent; antineoplastic agent; biological pigment; contraceptive drug; dye; EC 1.1.1.205 (IMP dehydrogenase) inhibitor; EC 1.1.1.21 (aldehyde reductase) inhibitor; EC 1.1.1.25 (shikimate dehydrogenase) inhibitor; EC 1.6.5.2 [NAD(P)H dehydrogenase (quinone)] inhibitor; EC 1.8.1.9 (thioredoxin reductase) inhibitor; EC 2.7.10.2 (non-specific protein-tyrosine kinase) inhibitor; EC 3.5.1.98 (histone deacetylase) inhibitor; flavouring agent; food colouring; geroprotector; hepatoprotective agent; immunomodulator; iron chelator; ligand; lipoxygenase inhibitor; metabolite; neuroprotective agent; nutraceutical; radical scavenger | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
zucapsaicin | | methoxybenzenes; phenols | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
nbd 556 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
thioguanine anhydrous | | 2-aminopurines | anticoronaviral agent; antimetabolite; antineoplastic agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
4,5,6,7-tetrachloroindan-1,3-dione | | | | 2023 | 2023 | 1.0 | high | 0 | 0 | 0 | 0 | 0 | 1 |
srpin340 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
pr-619 | | | | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
p5091 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
trovirdine | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
fti 277 | | | | 2023 | 2023 | 1.0 | high | 0 | 0 | 0 | 0 | 0 | 1 |
u 0126 | | aryl sulfide; dinitrile; enamine; substituted aniline | antineoplastic agent; antioxidant; apoptosis inducer; EC 2.7.11.24 (mitogen-activated protein kinase) inhibitor; osteogenesis regulator; vasoconstrictor agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
vicriviroc | | (trifluoromethyl)benzenes | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
telaprevir | | cyclopentapyrrole; cyclopropanes; oligopeptide; pyrazines | antiviral drug; hepatitis C protease inhibitor; peptidomimetic | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
orlistat | | beta-lactone; carboxylic ester; formamides; L-leucine derivative | anti-obesity agent; bacterial metabolite; EC 2.3.1.85 (fatty acid synthase) inhibitor; EC 3.1.1.3 (triacylglycerol lipase) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
dasatinib | | 1,3-thiazoles; aminopyrimidine; monocarboxylic acid amide; N-(2-hydroxyethyl)piperazine; N-arylpiperazine; organochlorine compound; secondary amino compound; tertiary amino compound | anticoronaviral agent; antineoplastic agent; tyrosine kinase inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
yya-021 | | | | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
sb 415286 | | C-nitro compound; maleimides; monochlorobenzenes; phenols; secondary amino compound; substituted aniline | antioxidant; apoptosis inducer; EC 2.7.11.26 (tau-protein kinase) inhibitor; neuroprotective agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
am 630 | | N-acylindole | | 2010 | 2010 | 14.0 | low | 0 | 0 | 0 | 1 | 0 | 0 |
sitagliptin | | triazolopyrazine; trifluorobenzene | EC 3.4.14.5 (dipeptidyl-peptidase IV) inhibitor; environmental contaminant; hypoglycemic agent; serine proteinase inhibitor; xenobiotic | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
tak-220 | | | | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
jtk-303 | | aromatic ether; monochlorobenzenes; organofluorine compound; quinolinemonocarboxylic acid; quinolone | HIV-1 integrase inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
nbd 557 | | | | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
dinoprostone | | prostaglandins E | human metabolite; mouse metabolite; oxytocic | 2010 | 2010 | 14.0 | low | 0 | 0 | 0 | 1 | 0 | 0 |
5'-o-caffeoylquinic acid | | cinnamate ester; cyclitol carboxylic acid | plant metabolite | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
luteolin-7-glucoside | | beta-D-glucoside; glycosyloxyflavone; monosaccharide derivative; trihydroxyflavone | antioxidant; plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
cyclosporine | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
harmine | | harmala alkaloid | anti-HIV agent; EC 1.4.3.4 (monoamine oxidase) inhibitor; metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
eprosartan | | dicarboxylic acid; imidazoles; thiophenes | angiotensin receptor antagonist; antihypertensive agent; environmental contaminant; xenobiotic | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
mycophenolate mofetil | | carboxylic ester; ether; gamma-lactone; phenols; tertiary amino compound | anticoronaviral agent; EC 1.1.1.205 (IMP dehydrogenase) inhibitor; immunosuppressive agent; prodrug | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
entacapone | | 2-nitrophenols; catechols; monocarboxylic acid amide; nitrile | antidyskinesia agent; antiparkinson drug; central nervous system drug; EC 2.1.1.6 (catechol O-methyltransferase) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
amentoflavone | | biflavonoid; hydroxyflavone; ring assembly | angiogenesis inhibitor; antiviral agent; cathepsin B inhibitor; P450 inhibitor; plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
baicalein | | trihydroxyflavone | angiogenesis inhibitor; anti-inflammatory agent; antibacterial agent; anticoronaviral agent; antifungal agent; antineoplastic agent; antioxidant; apoptosis inducer; EC 1.13.11.31 (arachidonate 12-lipoxygenase) inhibitor; EC 1.13.11.33 (arachidonate 15-lipoxygenase) inhibitor; EC 3.4.21.26 (prolyl oligopeptidase) inhibitor; EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor; EC 4.1.1.17 (ornithine decarboxylase) inhibitor; ferroptosis inhibitor; geroprotector; hormone antagonist; plant metabolite; prostaglandin antagonist; radical scavenger | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
genkwanin | | dihydroxyflavone; monomethoxyflavone | metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
hyperoside | | beta-D-galactoside; monosaccharide derivative; quercetin O-glycoside; tetrahydroxyflavone | hepatoprotective agent; plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
mangostin | | aromatic ether; phenols; xanthones | antimicrobial agent; antineoplastic agent; antioxidant; plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
3-methylquercetin | | 7-hydroxyflavonol; monomethoxyflavone; tetrahydroxyflavone | anticoagulant; EC 1.14.18.1 (tyrosinase) inhibitor; metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
kaempferide | | 7-hydroxyflavonol; monomethoxyflavone; trihydroxyflavone | antihypertensive agent; metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
orientin | | 3'-hydroxyflavonoid; C-glycosyl compound; tetrahydroxyflavone | antioxidant; metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
sciadopitysin | | biflavonoid; hydroxyflavone; methoxyflavone; ring assembly | bone density conservation agent; platelet aggregation inhibitor | 2010 | 2010 | 14.0 | low | 0 | 0 | 0 | 1 | 0 | 0 |
scutellarein | | tetrahydroxyflavone | metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
trans-2,3',4,5'-tetrahydroxystilbene | | stilbenoid | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
polydatin | | beta-D-glucoside; monosaccharide derivative; polyphenol; stilbenoid | anti-arrhythmia drug; antioxidant; geroprotector; hepatoprotective agent; metabolite; nephroprotective agent; potassium channel modulator | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
chicoric acid | | organooxygen compound | geroprotector; HIV-1 integrase inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
acteoside | | catechols; cinnamate ester; disaccharide derivative; glycoside; polyphenol | anti-inflammatory agent; antibacterial agent; antileishmanial agent; neuroprotective agent; plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
dorzolamide | | sulfonamide; thiophenes | antiglaucoma drug; antihypertensive agent; EC 4.2.1.1 (carbonic anhydrase) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
topiramate | | cyclic ketal; ketohexose derivative; sulfamate ester | anticonvulsant; sodium channel blocker | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
benzyloxycarbonyl-phe-ala-fluormethylketone | | | | 2023 | 2023 | 1.0 | high | 0 | 0 | 0 | 0 | 0 | 1 |
n-(n-(3,5-difluorophenacetyl)alanyl)phenylglycine tert-butyl ester | | carboxylic ester; difluorobenzene; dipeptide; tert-butyl ester | EC 3.4.23.46 (memapsin 2) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
casticin | | dihydroxyflavone; tetramethoxyflavone | apoptosis inducer; plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
5,7-dihydroxy-6-methoxy-2-phenylchromen-4-one | | dihydroxyflavone; monomethoxyflavone | antineoplastic agent; EC 1.14.13.39 (nitric oxide synthase) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
(E)-2,3,5,4'-tetrahydroxystilbene-2-O-beta-D-glucoside | | beta-D-glucoside; resorcinols; stilbenoid | anti-inflammatory agent; antioxidant; apoptosis inhibitor; cardioprotective agent; cyclooxygenase 2 inhibitor; platelet aggregation inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
tyrphostin ag 555 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
pd 151746 | | | | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
lisinopril | | dipeptide | EC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
verteporfin | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
batimastat | | hydroxamic acid; L-phenylalanine derivative; organic sulfide; secondary carboxamide; thiophenes; triamide | angiogenesis inhibitor; antineoplastic agent; matrix metalloproteinase inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
indinavir sulfate | | dicarboxylic acid diamide; N-(2-hydroxyethyl)piperazine; piperazinecarboxamide | HIV protease inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
solanesol | | nonaprenol; primary alcohol | plant metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
pepstatin | | pentapeptide; secondary carboxamide | bacterial metabolite; EC 3.4.23.* (aspartic endopeptidase) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
l 685458 | | carbamate ester; monocarboxylic acid amide; peptide; secondary alcohol | EC 3.4.23.46 (memapsin 2) inhibitor; peptidomimetic | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
bms 806 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
benzyloxycarbonylvalyl-alanyl-aspartyl fluoromethyl ketone | | | | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
tulobuterol hydrochloride | | organic molecular entity | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
salubrinal | | aminal; organochlorine compound; quinolines; secondary carboxamide; thioureas | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
germacrone | | germacrane sesquiterpenoid; olefinic compound | androgen antagonist; anti-inflammatory agent; antifeedant; antifungal agent; antimicrobial agent; antineoplastic agent; antioxidant; antitussive; antiviral agent; apoptosis inducer; autophagy inducer; hepatoprotective agent; insecticide; neuroprotective agent; plant metabolite; volatile oil component | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
(2e,4e,6e,10e)-3,7,11,15-tetramethyl-2,4,6,10,14-hexadecapentaenoic acid | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
lithospermic acid | | | | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
laq824 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
ekb 569 | | aminoquinoline; monocarboxylic acid amide; monochlorobenzenes; nitrile | protein kinase inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
rilpivirine | | aminopyrimidine; nitrile | EC 2.7.7.49 (RNA-directed DNA polymerase) inhibitor; HIV-1 reverse transcriptase inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
(1Ar,7aS,10aS,10bS)-1a,5-dimethyl-8-methylidene-2,3,6,7,7a,8,10a,10b-octahydrooxireno[9,10]cyclodeca[1,2-b]furan-9(1aH)-one | | germacranolide | | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
4,5-di-O-caffeoylquinic acid | | quinic acid | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
indigo carmine | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
artesunate | | artemisinin derivative; cyclic acetal; dicarboxylic acid monoester; hemisuccinate; semisynthetic derivative; sesquiterpenoid | antimalarial; antineoplastic agent; ferroptosis inducer | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
(3S,6S,9S,12R)-3-[(2S)-Butan-2-yl]-6-[(1-methoxyindol-3-yl)methyl]-9-(6-oxooctyl)-1,4,7,10-tetrazabicyclo[10.4.0]hexadecane-2,5,8,11-tetrone | | oligopeptide | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
nps2143 | | | | 2010 | 2010 | 14.0 | low | 0 | 0 | 0 | 1 | 0 | 0 |
jwh-133 | | benzochromene; dibenzopyran; organic heterotricyclic compound | analgesic; anti-inflammatory agent; antineoplastic agent; apoptosis inhibitor; CB2 receptor agonist; opioid analgesic; vasodilator agent | 2010 | 2010 | 14.0 | low | 0 | 0 | 0 | 1 | 0 | 0 |
vildagliptin | | amino acid amide | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
relacatib | | | | 2008 | 2010 | 15.0 | high | 0 | 0 | 0 | 2 | 0 | 0 |
belinostat | | hydroxamic acid; olefinic compound; sulfonamide | antineoplastic agent; EC 3.5.1.98 (histone deacetylase) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
hdac-42 | | amidobenzoic acid | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
chlorhexidine | | biguanides; monochlorobenzenes | antibacterial agent; antiinfective agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
gs-7340 | | 6-aminopurines; ether; isopropyl ester; L-alanine derivative; phosphoramidate ester | antiviral drug; HIV-1 reverse transcriptase inhibitor; prodrug | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
iniparib | | carbonyl compound; organohalogen compound | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
n-(2-amino-5-fluorobenzyl)-4-(n-(pyridine-3-acrylyl)aminomethyl)benzamide | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
pri-2205 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
mk 0752 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
ono4819 | | benzyl ether | | 2010 | 2010 | 14.0 | low | 0 | 0 | 0 | 1 | 0 | 0 |
givinostat | | carbamate ester | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
pd 144418 | | | | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
ca 074 | | | | 2018 | 2018 | 6.0 | medium | 0 | 0 | 0 | 0 | 1 | 0 |
bicyclol | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
midostaurin | | benzamides; gamma-lactam; indolocarbazole; organic heterooctacyclic compound | antineoplastic agent; EC 2.7.11.13 (protein kinase C) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
ly 450139 | | peptide | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
mk-0429 | | | | 2010 | 2010 | 14.0 | medium | 0 | 0 | 0 | 1 | 0 | 0 |
mocetinostat | | aminopyrimidine; benzamides; pyridines; secondary amino compound; secondary carboxamide; substituted aniline | antineoplastic agent; apoptosis inducer; autophagy inducer; cardioprotective agent; EC 3.5.1.98 (histone deacetylase) inhibitor; hepatotoxic agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
rivaroxaban | | aromatic amide; lactam; monocarboxylic acid amide; morpholines; organochlorine compound; oxazolidinone; thiophenes | anticoagulant; EC 3.4.21.6 (coagulation factor Xa) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
sb 3ct compound | | aromatic ether | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
ginsenoside rb1 | | ginsenoside; glycoside; tetracyclic triterpenoid | anti-inflammatory drug; anti-obesity agent; apoptosis inhibitor; neuroprotective agent; plant metabolite; radical scavenger | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
l-873724 | | | | 2008 | 2011 | 14.5 | medium | 0 | 0 | 0 | 1 | 1 | 0 |
rucaparib | | azepinoindole; caprolactams; organofluorine compound; secondary amino compound | antineoplastic agent; EC 2.4.2.30 (NAD(+) ADP-ribosyltransferase) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
6h-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine-6-acetamide, 4-(4-chlorophenyl)-n-(4-hydroxyphenyl)-2,3,9-trimethyl-, (6s)- | | organonitrogen heterocyclic compound; organosulfur heterocyclic compound | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
cetilistat | | benzoxazine | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
ym 201636 | | aromatic amide | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
linagliptin | | aminopiperidine; quinazolines | EC 3.4.14.5 (dipeptidyl-peptidase IV) inhibitor; hypoglycemic agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
azd 6244 | | benzimidazoles; bromobenzenes; hydroxamic acid ester; monochlorobenzenes; organofluorine compound; secondary amino compound | anticoronaviral agent; antineoplastic agent; EC 2.7.11.24 (mitogen-activated protein kinase) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
apilimod | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
apixaban | | aromatic ether; lactam; piperidones; pyrazolopyridine | anticoagulant; EC 3.4.21.6 (coagulation factor Xa) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
balicatib | | | | 2008 | 2012 | 13.5 | medium | 0 | 0 | 0 | 2 | 2 | 0 |
betrixaban | | benzamides; guanidines; monochloropyridine; monomethoxybenzene; secondary carboxamide | anticoagulant; EC 3.4.21.6 (coagulation factor Xa) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
edoxaban | | chloropyridine; monocarboxylic acid amide; tertiary amino compound; thiazolopyridine | anticoagulant; EC 3.4.21.6 (coagulation factor Xa) inhibitor; platelet aggregation inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
saracatinib | | aromatic ether; benzodioxoles; diether; N-methylpiperazine; organochlorine compound; oxanes; quinazolines; secondary amino compound | anticoronaviral agent; antineoplastic agent; apoptosis inducer; autophagy inducer; EC 2.7.10.2 (non-specific protein-tyrosine kinase) inhibitor; radiosensitizing agent | 2010 | 2023 | 7.5 | low | 0 | 0 | 0 | 1 | 0 | 1 |
n-(3-amino-1-(cyclobutylmethyl)-2,3-dioxopropyl)-3-(2-((((1,1-dimethylethyl)amino)carbonyl)amino)-3,3-dimethyl-1-oxobutyl)-6,6-dimethyl-3-azabicyclo(3.1.0)hexan-2-carboxamide | | tripeptide; ureas | antiviral drug; hepatitis C protease inhibitor; peptidomimetic | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
ly 411575 | | dibenzoazepine; difluorobenzene; lactam; secondary alcohol | EC 3.4.23.46 (memapsin 2) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
galidesivir | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
PB28 | | aromatic ether; piperazines; tetralins | anticoronaviral agent; antineoplastic agent; apoptosis inducer; sigma-2 receptor agonist | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
degrasyn | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
epoxomicin | | morpholines; tripeptide | proteasome inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
bms 477118 | | adamantanes; azabicycloalkane; monocarboxylic acid amide; nitrile; tertiary alcohol | EC 3.4.14.5 (dipeptidyl-peptidase IV) inhibitor; hypoglycemic agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
pha 680632 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
tmc 353121 | | | | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
amd 070 | | aminoquinoline | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
danoprevir | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
bms-626529 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
bms-663068 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
amenamevir | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
vx 765 | | dipeptide | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
Dihydrotanshinone I | | abietane diterpenoid | anticoronaviral agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
alogliptin | | nitrile; piperidines; primary amino compound; pyrimidines | EC 3.4.14.5 (dipeptidyl-peptidase IV) inhibitor; hypoglycemic agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
fr 180204 | | pyrazoles; ring assembly | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
quisinostat | | indoles | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
carfilzomib | | epoxide; morpholines; tetrapeptide | antineoplastic agent; proteasome inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
hcv 796 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
N-methyl-N-[2-[[[2-[(2-oxo-1,3-dihydroindol-5-yl)amino]-5-(trifluoromethyl)-4-pyrimidinyl]amino]methyl]phenyl]methanesulfonamide | | sulfonamide | | 2010 | 2010 | 14.0 | medium | 0 | 0 | 0 | 1 | 0 | 0 |
resminostat | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
zk 756326 | | aromatic ether | | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
balapiravir | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
trametinib | | acetamides; aromatic amine; cyclopropanes; organofluorine compound; organoiodine compound; pyridopyrimidine; ring assembly | anticoronaviral agent; antineoplastic agent; EC 2.7.11.24 (mitogen-activated protein kinase) inhibitor; geroprotector | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
pf-562,271 | | indoles | | 2010 | 2010 | 14.0 | low | 0 | 0 | 0 | 1 | 0 | 0 |
deoxyarbutin | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
abexinostat | | benzofurans | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
silvestrol | | dioxanes; ether; methyl ester; organic heterotricyclic compound | antineoplastic agent; metabolite | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
narlaprevir | | azabicyclohexane; cyclopropanes; pyrrolidinecarboxamide; secondary carboxamide; sulfone; tertiary carboxamide; ureas | anticoronaviral agent; antiviral drug; EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor; hepatitis C protease inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
teneligliptin | | amino acid amide | | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
dextrothyroxine | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
veliparib | | benzimidazoles | EC 2.4.2.30 (NAD(+) ADP-ribosyltransferase) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
pf 03491390 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
alloin | | anthracenes; C-glycosyl compound; cyclic ketone; phenols | laxative; metabolite | 2023 | 2023 | 1.0 | high | 0 | 0 | 0 | 0 | 0 | 1 |
mdv 3100 | | (trifluoromethyl)benzenes; benzamides; imidazolidinone; monofluorobenzenes; nitrile; thiocarbonyl compound | androgen antagonist; antineoplastic agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
bms-650032 | | oligopeptide | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
rg 7128 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
teriparatide | | polypeptide | | 2010 | 2010 | 14.0 | medium | 0 | 0 | 0 | 1 | 0 | 0 |
oritavancin | | disaccharide derivative; glycopeptide; semisynthetic derivative | antibacterial drug; antimicrobial agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
pevonedistat | | cyclopentanols; indanes; pyrrolopyrimidine; secondary amino compound; sulfamidate | antineoplastic agent; apoptosis inducer | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
WAY-316606 | | (trifluoromethyl)benzenes; piperidines; secondary amino compound; sulfonamide; sulfone | secreted frizzled-related protein 1 inhibitor | 2010 | 2010 | 14.0 | high | 0 | 0 | 0 | 1 | 0 | 0 |
uk 453,061 | | aromatic ether | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
N-(2-aminophenyl)-2-pyrazinecarboxamide | | aromatic amide | | 2023 | 2023 | 1.0 | high | 0 | 0 | 0 | 0 | 0 | 1 |
tegobuvir | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
pf-429242 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
olaparib | | cyclopropanes; monofluorobenzenes; N-acylpiperazine; phthalazines | antineoplastic agent; apoptosis inducer; EC 2.4.2.30 (NAD(+) ADP-ribosyltransferase) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
cx 4945 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
pci 34051 | | indolecarboxamide | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
lomibuvir | | thiophenecarboxylic acid | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
delanzomib | | C-terminal boronic acid peptide; phenylpyridine; secondary alcohol; threonine derivative | antineoplastic agent; apoptosis inducer; proteasome inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
pitavastatin(1-) | | hydroxy monocarboxylic acid anion | | 2023 | 2023 | 1.0 | high | 0 | 0 | 0 | 0 | 0 | 1 |
GRL-0617 | | benzamides; naphthalenes; secondary carboxamide; substituted aniline | anticoronaviral agent; protease inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
N-[4-[3-[[[7-(hydroxyamino)-7-oxoheptyl]amino]-oxomethyl]-5-isoxazolyl]phenyl]carbamic acid tert-butyl ester | | carbamate ester | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
niraparib | | 2-[4-(piperidin-3-yl)phenyl]-2H-indazole-7-carboxamide | antineoplastic agent; apoptosis inducer; EC 2.4.2.30 (NAD(+) ADP-ribosyltransferase) inhibitor; radiosensitizing agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
jzl 184 | | benzodioxoles | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
gsk 650394 | | phenylpyridine | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
oprozomib | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
az 960 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
vel-0230 | | | | 2010 | 2010 | 14.0 | high | 0 | 0 | 0 | 1 | 0 | 0 |
golgicide a | | diastereoisomeric mixture | cis-Golgi ArfGEF GBF inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
cobicistat | | 1,3-thiazoles; carbamate ester; monocarboxylic acid amide; morpholines; ureas | P450 inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
bms-790052 | | biphenyls; carbamate ester; carboxamide; imidazoles; valine derivative | antiviral drug; nonstructural protein 5A inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
ixazomib | | benzamides; boronic acids; dichlorobenzene; glycine derivative | antineoplastic agent; apoptosis inducer; drug metabolite; orphan drug; proteasome inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
ucph 101 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
5-(3-methylsulfonylphenyl)-4-[(1-methyl-5-tetrazolyl)thio]thieno[2,3-d]pyrimidine | | aryl sulfide; thienopyrimidine | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
baricitinib | | azetidines; nitrile; pyrazoles; pyrrolopyrimidine; sulfonamide | anti-inflammatory agent; antirheumatic drug; antiviral agent; EC 2.7.10.2 (non-specific protein-tyrosine kinase) inhibitor; immunosuppressive agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
KOM70144 | | acetamides; benzamides; naphthalenes; secondary carboxamide | anticoronaviral agent; protease inhibitor | 2023 | 2023 | 1.0 | high | 0 | 0 | 0 | 0 | 0 | 1 |
e-52862 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
ly2811376 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
anagliptin | | amino acid amide | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
gardiquimod | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
grazoprevir | | aromatic ether; azamacrocycle; carbamate ester; cyclopropanes; lactam; N-sulfonylcarboxamide; quinoxaline derivative | antiviral drug; hepatitis C protease inhibitor; hepatoprotective agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
abt-450 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
letermovir | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
sofosbuvir | | isopropyl ester; L-alanyl ester; nucleotide conjugate; organofluorine compound; phosphoramidate ester | antiviral drug; hepatitis C protease inhibitor; prodrug | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
5-(4-amino-1-propan-2-yl-3-pyrazolo[3,4-d]pyrimidinyl)-1,3-benzoxazol-2-amine | | benzoxazole | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
blz 945 | | | | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
azd3839 | | | | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
pf 3084014 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
unc 0638 | | quinazolines | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
gs-9620 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
n-((5-(methanesulfonyl)pyridin-2-yl)methyl)-6-methyl-5-(1-methyl-1h-pyrazol-5-yl)-2-oxo-1-(3-(trifluoromethyl)phenyl)-1,2-dihydropyridine-3-carboxamide | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
bms 708163 | | oxadiazole; ring assembly | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
jq1 compound | | carboxylic ester; organochlorine compound; tert-butyl ester; thienotriazolodiazepine | angiogenesis inhibitor; anti-inflammatory agent; antineoplastic agent; apoptosis inducer; bromodomain-containing protein 4 inhibitor; cardioprotective agent; ferroptosis inducer | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
1-(5-((2,4-difluorophenyl)thio)-4-nitrothiophen-2-yl)ethanone | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
gsk525762a | | benzodiazepine | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
ML240 | | aromatic amine; aromatic ether; benzimidazoles; primary amino compound; quinazolines; secondary amino compound | antineoplastic agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
birinapant | | dipeptide | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
ly2886721 | | | | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
nms-p118 | | | | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
tubastatin a | | hydroxamic acid; pyridoindole; tertiary amino compound | EC 3.5.1.98 (histone deacetylase) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
pracinostat | | benzimidazole; hydroxamic acid; olefinic compound; tertiary amino compound | antimalarial; antineoplastic agent; apoptosis inducer; EC 3.5.1.98 (histone deacetylase) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
spautin-1 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
ldn 57444 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
gsk1210151a | | imidazoquinoline | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
i-bet726 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
acy-1215 | | pyrimidinecarboxylic acid | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
cudc-907 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
mobic | | 1,3-thiazoles; benzothiazine; monocarboxylic acid amide | analgesic; antirheumatic drug; cyclooxygenase 2 inhibitor; non-steroidal anti-inflammatory drug | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
tipranavir | | sulfonamide | antiviral drug; HIV protease inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
tasquinimod | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
gsk1265744 | | difluorobenzene; monocarboxylic acid amide; organic heterotricyclic compound; secondary carboxamide | HIV-1 integrase inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
abt-267 | | aromatic amide; carbamate ester; dipeptide; pyrrolidines | antiviral drug; hepatitis C virus nonstructural protein 5A inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
abt-333 | | aromatic ether; naphthalenes; pyrimidone; sulfonamide | antiviral drug; nonnucleoside hepatitis C virus polymerase inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
rgfp966 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
rg2833 | | | | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
pi-1840 | | | | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
acy-738 | | | | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
pelabresib | | monochlorobenzenes; organic heterotricyclic compound; primary carboxamide | antineoplastic agent; bromodomain-containing protein 4 inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
gs-5806 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
doravirine | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
gn6958 | | | | 2023 | 2023 | 1.0 | high | 0 | 0 | 0 | 0 | 0 | 1 |
vx-787 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
ledipasvir | | azaspiro compound; benzimidazole; bridged compound; carbamate ester; carboxamide; fluorenes; imidazoles; L-valine derivative; N-acylpyrrolidine; organofluorine compound | antiviral drug; hepatitis C protease inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
gs-5816 | | carbamate ester; ether; imidazoles; L-valine derivative; N-acylpyrrolidine; organic heteropentacyclic compound; ring assembly | antiviral drug; hepatitis C virus nonstructural protein 5A inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
g007-lk | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
4-((1-butyl-3-phenylureido)methyl)-n-hydroxybenzamide | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
selinexor | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
verdinexor | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
cb-839 | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
mk-8742 | | carbamate ester; imidazoles; L-valine derivative; N-acylpyrrolidine; organic heterotetracyclic compound; ring assembly | antiviral drug; hepatitis C virus nonstructural protein 5A inhibitor; hepatoprotective agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
atglistatin | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
xen445 | | | | 2023 | 2023 | 1.0 | high | 0 | 0 | 0 | 0 | 0 | 1 |
santacruzamate a | | organonitrogen compound; organooxygen compound | | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
ldc4297 | | aromatic ether; piperidines; pyrazoles; pyrazolotriazine; secondary amino compound | antineoplastic agent; antiviral agent; apoptosis inducer; EC 2.7.11.22 (cyclin-dependent kinase) inhibitor | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
enasidenib | | 1,3,5-triazines; aminopyridine; aromatic amine; organofluorine compound; secondary amino compound; tertiary alcohol | antineoplastic agent; EC 1.1.1.42 (isocitrate dehydrogenase) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
s 8932 | | aromatic amine; C-nucleoside; carboxylic ester; nitrile; phosphoramidate ester; pyrrolotriazine | anticoronaviral agent; antiviral drug; prodrug | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
entecavir | | 2-aminopurines; oxopurine; primary alcohol; secondary alcohol | antiviral drug; EC 2.7.7.49 (RNA-directed DNA polymerase) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
acyclovir | | 2-aminopurines; oxopurine | antimetabolite; antiviral drug | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
nu 1025 | | phenols; quinazolines | EC 2.4.2.30 (NAD(+) ADP-ribosyltransferase) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
didanosine | | purine 2',3'-dideoxyribonucleoside | antimetabolite; antiviral drug; EC 2.4.2.1 (purine-nucleoside phosphorylase) inhibitor; geroprotector; HIV-1 reverse transcriptase inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
ganciclovir | | 2-aminopurines; oxopurine | antiinfective agent; antiviral drug | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
valacyclovir | | L-valyl ester | antiviral drug | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
penciclovir | | 2-aminopurines; propane-1,3-diols | antiviral drug | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
4-hydroxyquinazoline | | quinazolines | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
tegaserod | | carboxamidine; guanidines; hydrazines; indoles | gastrointestinal drug; serotonergic agonist | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
norclozapine | | dibenzodiazepine; organochlorine compound; piperazines | delta-opioid receptor agonist; metabolite; serotonergic antagonist | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
pemetrexed | | N-acyl-L-glutamic acid; pyrrolopyrimidine | antimetabolite; antineoplastic agent; EC 1.5.1.3 (dihydrofolate reductase) inhibitor; EC 2.1.1.45 (thymidylate synthase) inhibitor; EC 2.1.2.2 (phosphoribosylglycinamide formyltransferase) inhibitor | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
aprepitant | | (trifluoromethyl)benzenes; cyclic acetal; morpholines; triazoles | antidepressant; antiemetic; neurokinin-1 receptor antagonist; peripheral nervous system drug; substance P receptor antagonist | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
azilsartan | | 1,2,4-oxadiazole; aromatic ether; benzimidazolecarboxylic acid | angiotensin receptor antagonist; antihypertensive agent | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
hesperadin | | | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
6-bromoindirubin-3'-acetoxime | | | | 2023 | 2023 | 1.0 | high | 0 | 0 | 0 | 0 | 0 | 1 |
n'-(3,4-dihydroxybenzylidene)-3-hydroxy-2-naphthahydrazide | | catechols; hydrazide; hydrazone; naphthols | EC 3.6.5.5 (dynamin GTPase) inhibitor | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
XL413 | | benzofuropyrimidine; organochlorine compound; pyrrolidines | antineoplastic agent; EC 2.7.11.1 (non-specific serine/threonine protein kinase) inhibitor | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
me0328 | | | | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
nvp-tnks656 | | | | 2023 | 2023 | 1.0 | medium | 0 | 0 | 0 | 0 | 0 | 1 |
In vivo quantitative high-throughput screening for drug discovery and comparative toxicology.Disease models & mechanisms, , 03-01, Volume: 16, Issue:3, 2023
Emerging targets in osteoporosis disease modification.Journal of medicinal chemistry, , Jun-10, Volume: 53, Issue:11, 2010
Emerging targets in osteoporosis disease modification.Journal of medicinal chemistry, , Jun-10, Volume: 53, Issue:11, 2010
The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K.Bioorganic & medicinal chemistry letters, , Feb-01, Volume: 18, Issue:3, 2008
Difluoroethylamines as an amide isostere in inhibitors of cathepsin K.Bioorganic & medicinal chemistry letters, , Feb-01, Volume: 21, Issue:3, 2011
The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K.Bioorganic & medicinal chemistry letters, , Feb-01, Volume: 18, Issue:3, 2008
Pharmacokinetic benefits of 3,4-dimethoxy substitution of a phenyl ring and design of isosteres yielding orally available cathepsin K inhibitors.Journal of medicinal chemistry, , Oct-25, Volume: 55, Issue:20, 2012
(1R,2R)-N-(1-cyanocyclopropyl)-2-(6-methoxy-1,3,4,5-tetrahydropyrido[4,3-b]indole-2-carbonyl)cyclohexanecarboxamide (AZD4996): a potent and highly selective cathepsin K inhibitor for the treatment of osteoarthritis.Journal of medicinal chemistry, , Jul-26, Volume: 55, Issue:14, 2012
Emerging targets in osteoporosis disease modification.Journal of medicinal chemistry, , Jun-10, Volume: 53, Issue:11, 2010
The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K.Bioorganic & medicinal chemistry letters, , Feb-01, Volume: 18, Issue:3, 2008
In vivo quantitative high-throughput screening for drug discovery and comparative toxicology.Disease models & mechanisms, , 03-01, Volume: 16, Issue:3, 2023
Emerging targets in osteoporosis disease modification.Journal of medicinal chemistry, , Jun-10, Volume: 53, Issue:11, 2010
Condition | Indicated | Studies | First Year | Last Year | Average Age | Relationship Strength | Trials | pre-1990 | 1990's | 2000's | 2010's | post-2020 |
African Sleeping Sickness | 0 | | 2012 | 2012 | 12.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Age-Related Osteoporosis | 0 | | 2009 | 2023 | 9.2 | medium | 6 | 0 | 0 | 3 | 35 | 4 |
Alveolar Bone Atrophy | 0 | | 2015 | 2015 | 9.0 | low | 0 | 0 | 0 | 0 | 3 | 0 |
American Trypanosomiasis | 0 | | 2012 | 2012 | 12.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Anoxemia | 0 | | 2012 | 2012 | 12.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Apoplexy | 0 | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
Arthritis, Degenerative | 0 | | 2012 | 2012 | 12.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Arthritis, Rheumatoid | 0 | | 2009 | 2009 | 15.0 | low | 0 | 0 | 0 | 1 | 0 | 0 |
Bacterial Infections, Gram-Negative | 0 | | 2015 | 2015 | 9.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Bacteroidaceae Infections | 0 | | 2015 | 2015 | 9.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Bejel | 0 | | 2015 | 2015 | 9.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Benign Neoplasms | 0 | | 2009 | 2009 | 15.0 | low | 0 | 0 | 0 | 1 | 0 | 0 |
Body Weight | 0 | | 2020 | 2020 | 4.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Bone Cancer | 0 | | 2008 | 2012 | 14.2 | low | 1 | 0 | 0 | 4 | 1 | 0 |
Bone Diseases | 0 | | 2015 | 2015 | 9.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Bone Diseases, Metabolic | 0 | | 2011 | 2016 | 9.7 | low | 0 | 0 | 0 | 0 | 3 | 0 |
Bone Fractures | 0 | | 2011 | 2023 | 8.3 | low | 1 | 0 | 0 | 0 | 5 | 1 |
Bone Loss, Osteoclastic | 0 | | 2008 | 2022 | 10.5 | low | 5 | 0 | 0 | 6 | 19 | 2 |
Bone Loss, Perimenopausal | 0 | | 2008 | 2023 | 9.6 | medium | 14 | 0 | 0 | 6 | 26 | 4 |
Bone Neoplasms | 0 | | 2008 | 2012 | 14.2 | low | 1 | 0 | 0 | 4 | 1 | 0 |
Breast Cancer | 0 | | 2008 | 2021 | 9.6 | low | 1 | 0 | 0 | 2 | 1 | 2 |
Breast Neoplasms | 1 | | 2008 | 2021 | 9.6 | low | 1 | 0 | 0 | 2 | 1 | 2 |
Cancer of Kidney | 0 | | 2020 | 2020 | 4.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Cancer of Prostate | 0 | | 2008 | 2012 | 14.0 | low | 0 | 0 | 0 | 1 | 1 | 0 |
Caries, Dental | 0 | | 2015 | 2015 | 9.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Chagas Disease | 0 | | 2012 | 2012 | 12.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Congenital Zika Syndrome | 0 | | 2020 | 2020 | 4.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Deficiency, Vitamin D | 0 | | 2011 | 2011 | 13.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Dental Caries | 0 | | 2015 | 2015 | 9.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Dermatosclerosis | 0 | | 2021 | 2021 | 3.0 | low | 1 | 0 | 0 | 0 | 0 | 1 |
Diabetes Mellitus, Adult-Onset | 0 | | 2022 | 2022 | 2.0 | low | 1 | 0 | 0 | 0 | 0 | 1 |
Diabetes Mellitus, Type 2 | 0 | | 2022 | 2022 | 2.0 | low | 1 | 0 | 0 | 0 | 0 | 1 |
Disease Models, Animal | 0 | | 2012 | 2020 | 8.4 | low | 0 | 0 | 0 | 0 | 7 | 0 |
Electrocardiogram QT Prolonged | 0 | | 2019 | 2019 | 5.0 | low | 1 | 0 | 0 | 0 | 1 | 0 |
Fractures, Bone | 0 | | 2011 | 2023 | 8.3 | low | 1 | 0 | 0 | 0 | 5 | 1 |
Gram-Negative Bacterial Infections | 0 | | 2015 | 2015 | 9.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Hangman Fracture | 0 | | 2018 | 2019 | 5.5 | low | 1 | 0 | 0 | 0 | 2 | 0 |
Hip Fractures | 0 | | 2019 | 2022 | 3.3 | low | 3 | 0 | 0 | 0 | 1 | 2 |
Hypoxia | 0 | | 2012 | 2012 | 12.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Intertrochanteric Fractures | 0 | | 2019 | 2022 | 3.3 | low | 3 | 0 | 0 | 0 | 1 | 2 |
Invasiveness, Neoplasm | 0 | | 2021 | 2021 | 3.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
Kidney Failure | 0 | | 2020 | 2020 | 4.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Kidney Neoplasms | 0 | | 2020 | 2020 | 4.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Leishmania Infection | 0 | | 2012 | 2012 | 12.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Leishmaniasis | 0 | | 2012 | 2012 | 12.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Long QT Syndrome | 0 | | 2019 | 2019 | 5.0 | low | 1 | 0 | 0 | 0 | 1 | 0 |
Low Bone Density | 0 | | 2011 | 2016 | 9.7 | low | 0 | 0 | 0 | 0 | 3 | 0 |
Margins of Excision | 0 | | 2019 | 2019 | 5.0 | low | 1 | 0 | 0 | 0 | 1 | 0 |
Mesial Drift of Teeth | 0 | | 2019 | 2019 | 5.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Metastase | 0 | | 2010 | 2021 | 8.5 | low | 0 | 0 | 0 | 1 | 0 | 1 |
Neoplasm Metastasis | 0 | | 2010 | 2021 | 8.5 | low | 0 | 0 | 0 | 1 | 0 | 1 |
Neoplasms | 0 | | 2009 | 2009 | 15.0 | low | 0 | 0 | 0 | 1 | 0 | 0 |
Osteoarthritis | 1 | | 2012 | 2012 | 12.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Osteolysis | 0 | | 2012 | 2012 | 12.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Osteoporosis | 1 | | 2009 | 2023 | 9.2 | medium | 6 | 0 | 0 | 3 | 35 | 4 |
Osteoporosis, Postmenopausal | 1 | | 2008 | 2023 | 9.6 | medium | 14 | 0 | 0 | 6 | 26 | 4 |
Osteoporotic Fractures | 0 | | 2011 | 2019 | 8.9 | low | 3 | 0 | 0 | 0 | 12 | 0 |
Periapical Periodontitis | 0 | | 2015 | 2015 | 9.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Pericementitis | 0 | | 2015 | 2015 | 9.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Periodontitis | 0 | | 2015 | 2015 | 9.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Periodontitis, Acute Nonsuppurative | 0 | | 2015 | 2015 | 9.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Prostatic Neoplasms | 0 | | 2008 | 2012 | 14.0 | low | 0 | 0 | 0 | 1 | 1 | 0 |
Recrudescence | 0 | | 2018 | 2019 | 5.5 | low | 0 | 0 | 0 | 0 | 2 | 0 |
Renal Insufficiency | 1 | | 2020 | 2020 | 4.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Rheumatoid Arthritis | 0 | | 2009 | 2009 | 15.0 | low | 0 | 0 | 0 | 1 | 0 | 0 |
Root Resorption | 0 | | 2015 | 2015 | 9.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Scleroderma, Localized | 0 | | 2021 | 2021 | 3.0 | low | 1 | 0 | 0 | 0 | 0 | 1 |
Scleroderma, Systemic | 0 | | 2021 | 2021 | 3.0 | low | 1 | 0 | 0 | 0 | 0 | 1 |
Sclerosis, Systemic | 0 | | 2021 | 2021 | 3.0 | low | 1 | 0 | 0 | 0 | 0 | 1 |
Spinal Fractures | 0 | | 2018 | 2019 | 5.5 | low | 1 | 0 | 0 | 0 | 2 | 0 |
Stroke | 0 | | 2023 | 2023 | 1.0 | low | 0 | 0 | 0 | 0 | 0 | 1 |
Tooth Drift | 0 | | 2019 | 2019 | 5.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Trypanosomiasis, African | 0 | | 2012 | 2012 | 12.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Vitamin D Deficiency | 0 | | 2011 | 2011 | 13.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Zika Virus Infection | 0 | | 2020 | 2020 | 4.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Odanacatib Restores Trabecular Bone of Skeletally Mature Female Rabbits With Osteopenia but Induces Brittleness of Cortical Bone: A Comparative Study of the Investigational Drug With PTH, Estrogen, and Alendronate.Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 31, Issue:3, 2016
Odanacatib, effects of 16-month treatment and discontinuation of therapy on bone mass, turnover and strength in the ovariectomized rabbit model of osteopenia.Bone, , Volume: 93, 2016
Cathepsin K inhibitors prevent bone loss in estrogen-deficient rabbits.Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 26, Issue:2, 2011
Bone metastases: molecular mechanisms and novel therapeutic interventions.Medicinal research reviews, , Volume: 32, Issue:3, 2012
New approaches to treating and preventing bone metastases.Current opinion in supportive and palliative care, , Volume: 4, Issue:3, 2010
The cathepsin K inhibitor odanacatib suppresses bone resorption in women with breast cancer and established bone metastases: results of a 4-week, double-blind, randomized, controlled trial.Clinical breast cancer, , Dec-01, Volume: 10, Issue:6, 2010
Odanacatib, a cathepsin K inhibitor for the treatment of osteoporosis and other skeletal disorders associated with excessive bone remodeling.IDrugs : the investigational drugs journal, , Volume: 12, Issue:12, 2009
Cathepsin K inhibitors as treatment of bone metastasis.Current opinion in supportive and palliative care, , Volume: 2, Issue:3, 2008
Inhibitory effect of cathepsin K inhibitor (ODN-MK-0822) on invasion, migration and adhesion of human breast cancer cells in vitro.Molecular biology reports, , Volume: 48, Issue:1, 2021
Inhibitory Effects of Cathepsin K Inhibitor (ODN-MK-0822) on the Paracrine Pro-Osteoclast Factors of Breast Cancer Cells.Current molecular pharmacology, , Volume: 14, Issue:6, 2021
Bone metastases: molecular mechanisms and novel therapeutic interventions.Medicinal research reviews, , Volume: 32, Issue:3, 2012
The cathepsin K inhibitor odanacatib suppresses bone resorption in women with breast cancer and established bone metastases: results of a 4-week, double-blind, randomized, controlled trial.Clinical breast cancer, , Dec-01, Volume: 10, Issue:6, 2010
Cathepsin K inhibitors as treatment of bone metastasis.Current opinion in supportive and palliative care, , Volume: 2, Issue:3, 2008
Diabetes Mellitus and the Benefit of Antiresorptive Therapy on Fracture Risk.Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 37, Issue:11, 2022
Incidence of Hip and Subtrochanteric/Femoral Shaft Fractures in Postmenopausal Women With Osteoporosis in the Phase 3 Long-Term Odanacatib Fracture Trial.Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 36, Issue:7, 2021
Odanacatib for the treatment of postmenopausal osteoporosis: results of the LOFT multicentre, randomised, double-blind, placebo-controlled trial and LOFT Extension study.The lancet. Diabetes & endocrinology, , Volume: 7, Issue:12, 2019
(1R,2R)-N-(1-cyanocyclopropyl)-2-(6-methoxy-1,3,4,5-tetrahydropyrido[4,3-b]indole-2-carbonyl)cyclohexanecarboxamide (AZD4996): a potent and highly selective cathepsin K inhibitor for the treatment of osteoarthritis.Journal of medicinal chemistry, , Jul-26, Volume: 55, Issue:14, 2012
Efficacy and safety of odanacatib for osteoporosis treatment: a systematic review and meta-analysis.Archives of osteoporosis, , 05-11, Volume: 18, Issue:1, 2023
Diabetes Mellitus and the Benefit of Antiresorptive Therapy on Fracture Risk.Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 37, Issue:11, 2022
Incidence of Hip and Subtrochanteric/Femoral Shaft Fractures in Postmenopausal Women With Osteoporosis in the Phase 3 Long-Term Odanacatib Fracture Trial.Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 36, Issue:7, 2021
Randomized, controlled trial to assess the safety and efficacy of odanacatib in the treatment of men with osteoporosis.Osteoporosis international : a journal established as result of cooperation between the European Foundation for Osteoporosis and the National Osteoporosis Foundation of the USA, , Volume: 32, Issue:1, 2021
Effects of Odanacatib on Bone Structure and Quality in Postmenopausal Women With Osteoporosis: 5-Year Data From the Phase 3 Long-Term Odanacatib Fracture Trial (LOFT) and its Extension.Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 35, Issue:7, 2020
Clinical and translational pharmacology of the cathepsin K inhibitor odanacatib studied for osteoporosis.British journal of clinical pharmacology, , Volume: 85, Issue:6, 2019
A Mild Inhibition of Cathepsin K Paradoxically Stimulates the Resorptive Activity of Osteoclasts in Culture.Calcified tissue international, , Volume: 104, Issue:1, 2019
The quest for new drugs to prevent osteoporosis-related fractures.Climacteric : the journal of the International Menopause Society, , Volume: 20, Issue:2, 2017
Merck &Co. drops osteoporosis drug odanacatib.Nature reviews. Drug discovery, , Sep-29, Volume: 15, Issue:10, 2016
Two pioneering osteoporosis drugs finally approach approval.Nature reviews. Drug discovery, , Jun-30, Volume: 15, Issue:7, 2016
Cathepsin K Inhibition: A New Mechanism for the Treatment of Osteoporosis.Calcified tissue international, , Volume: 98, Issue:4, 2016
Odanacatib Restores Trabecular Bone of Skeletally Mature Female Rabbits With Osteopenia but Induces Brittleness of Cortical Bone: A Comparative Study of the Investigational Drug With PTH, Estrogen, and Alendronate.Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 31, Issue:3, 2016
Novel advances in the treatment of osteoporosis.British medical bulletin, , Volume: 119, Issue:1, 2016
Short-term and long-term effects of osteoporosis therapies.Nature reviews. Endocrinology, , Volume: 11, Issue:7, 2015
Odanacatib for the treatment of osteoporosis.Expert opinion on pharmacotherapy, , Volume: 16, Issue:11, 2015
Efficacy and safety of odanacatib treatment for patients with osteoporosis: a meta-analysis.Journal of bone and mineral metabolism, , Volume: 33, Issue:4, 2015
[Osteoporosis].Revue medicale suisse, , Jan-14, Volume: 11, Issue:456-457, 2015
From Bone Cell Biology to Novel Therapies of Osteoporosis.Drug research, , Volume: 65 Suppl 1, 2015
Osteoporosis therapy: a novel insight from natural homeostatic system in the skeleton.Osteoporosis international : a journal established as result of cooperation between the European Foundation for Osteoporosis and the National Osteoporosis Foundation of the USA, , Volume: 26, Issue:2, 2015
Molecular and cellular basis of bone resorption.Wiener medizinische Wochenschrift (1946), , Volume: 165, Issue:3-4, 2015
On the horizon: better bone-building drugs?Mayo Clinic health letter (English ed.), , Volume: 32, Issue:12, 2014
Effect of odanacatib on BMD and fractures: estimates from Bayesian univariate and bivariate meta-analyses.The Journal of clinical endocrinology and metabolism, , Volume: 99, Issue:9, 2014
New therapeutics for osteoporosis.Current opinion in pharmacology, , Volume: 16, 2014
[Drug treatment of osteoporosis].Deutsche medizinische Wochenschrift (1946), , Volume: 139, Issue:10, 2014
Implications of osteoblast-osteoclast interactions in the management of osteoporosis by antiresorptive agents denosumab and odanacatib.Current osteoporosis reports, , Volume: 12, Issue:1, 2014
[Novel strategies for the development of anabolic agents for treatment of osteoporosis].Nihon yakurigaku zasshi. Folia pharmacologica Japonica, , Volume: 144, Issue:6, 2014
Current and future treatments of osteoporosis in men.Best practice & research. Clinical endocrinology & metabolism, , Volume: 28, Issue:6, 2014
Future directions for new medical entities in osteoporosis.Best practice & research. Clinical endocrinology & metabolism, , Volume: 28, Issue:6, 2014
[Reducing bone resorption by cathepsin K inhibitor and treatment of osteoporosis].Clinical calcium, , Volume: 24, Issue:1, 2014
Status of drug development for the prevention and treatment of osteoporosis.Expert opinion on drug discovery, , Volume: 9, Issue:3, 2014
Effect of the cathepsin K inhibitor odanacatib administered once weekly on bone mineral density in Japanese patients with osteoporosis--a double-blind, randomized, dose-finding study.Osteoporosis international : a journal established as result of cooperation between the European Foundation for Osteoporosis and the National Osteoporosis Foundation of the USA, , Volume: 25, Issue:1, 2014
Odanacatib, a selective cathepsin K inhibitor to treat osteoporosis: safety, tolerability, pharmacokinetics and pharmacodynamics--results from single oral dose studies in healthy volunteers.British journal of clinical pharmacology, , Volume: 75, Issue:5, 2013
Inhibition of cathepsin K for treatment of osteoporosis.Current osteoporosis reports, , Volume: 10, Issue:1, 2012
Evaluation of high-resolution peripheral quantitative computed tomography, finite element analysis and biomechanical testing in a pre-clinical model of osteoporosis: a study with odanacatib treatment in the ovariectomized adult rhesus monkey.Bone, , Volume: 50, Issue:6, 2012
Potential first-in-class osteoporosis drug speeds through trials.Nature medicine, , Volume: 18, Issue:8, 2012
[Odanacatib (MK-0822)].Clinical calcium, , Volume: 21, Issue:1, 2011
Discontinuation of odanacatib and other osteoporosis treatments: here today and gone tomorrow?Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 26, Issue:2, 2011
[Innovations in the treatment of osteoporosis].Deutsche medizinische Wochenschrift (1946), , Volume: 136, Issue:48, 2011
Osteoporosis: now and the future.Lancet (London, England), , Apr-09, Volume: 377, Issue:9773, 2011
Emerging targets in osteoporosis disease modification.Journal of medicinal chemistry, , Jun-10, Volume: 53, Issue:11, 2010
[Bone remodeling: new therapeutic approaches].Revue medicale suisse, , Jun-10, Volume: 5, Issue:207, 2009
Investigation of ketone warheads as alternatives to the nitrile for preparation of potent and selective cathepsin K inhibitors.Bioorganic & medicinal chemistry letters, , Feb-01, Volume: 19, Issue:3, 2009
Efficacy and safety of odanacatib for osteoporosis treatment: a systematic review and meta-analysis.Archives of osteoporosis, , 05-11, Volume: 18, Issue:1, 2023
Effects of odanacatib on bone-turnover markers in osteoporotic postmenopausal women: a post hoc analysis of the LOFT study.Osteoporosis international : a journal established as result of cooperation between the European Foundation for Osteoporosis and the National Osteoporosis Foundation of the USA, , Volume: 33, Issue:10, 2022
Incidence of Hip and Subtrochanteric/Femoral Shaft Fractures in Postmenopausal Women With Osteoporosis in the Phase 3 Long-Term Odanacatib Fracture Trial.Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 36, Issue:7, 2021
Morphea-like skin lesions reported in the phase 3 Long-Term Odanacatib Fracture Trial (LOFT) in postmenopausal women with osteoporosis.Journal of the American Academy of Dermatology, , Volume: 84, Issue:4, 2021
Effects of Odanacatib on Bone Structure and Quality in Postmenopausal Women With Osteoporosis: 5-Year Data From the Phase 3 Long-Term Odanacatib Fracture Trial (LOFT) and its Extension.Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 35, Issue:7, 2020
Population Pharmacokinetic Analysis of the Cathepsin K Inhibitor Odanacatib: Insights Into Intrinsic and Extrinsic Factor Effects on Exposure in Postmenopausal and Elderly Women.Journal of clinical pharmacology, , Volume: 60, Issue:8, 2020
Odanacatib for the treatment of postmenopausal osteoporosis: results of the LOFT multicentre, randomised, double-blind, placebo-controlled trial and LOFT Extension study.The lancet. Diabetes & endocrinology, , Volume: 7, Issue:12, 2019
Treatment with zoledronic acid subsequent to odanacatib prevents bone loss in postmenopausal women with osteoporosis.Osteoporosis international : a journal established as result of cooperation between the European Foundation for Osteoporosis and the National Osteoporosis Foundation of the USA, , Volume: 30, Issue:5, 2019
Odanacatib: the best osteoporosis treatment we never had?The lancet. Diabetes & endocrinology, , Volume: 7, Issue:12, 2019
Multiple vertebral fractures following osteoporosis treatment discontinuation: a case-report after long-term Odanacatib.Osteoporosis international : a journal established as result of cooperation between the European Foundation for Osteoporosis and the National Osteoporosis Foundation of the USA, , Volume: 29, Issue:4, 2018
Continuous treatment with odanacatib for up to 8 years in postmenopausal women with low bone mineral density: a phase 2 study.Osteoporosis international : a journal established as result of cooperation between the European Foundation for Osteoporosis and the National Osteoporosis Foundation of the USA, , Volume: 27, Issue:6, 2016
Pharmacological inhibition of cathepsin K: A promising novel approach for postmenopausal osteoporosis therapy.Biochemical pharmacology, , 10-01, Volume: 117, 2016
[Cathepsin K antagonists: preclinical and clinical data].Wiener medizinische Wochenschrift (1946), , Volume: 165, Issue:3-4, 2015
Cathepsin K inhibitors: emerging treatment options for osteoporosis.Wiener medizinische Wochenschrift (1946), , Volume: 165, Issue:3-4, 2015
Odanacatib: an emerging novel treatment alternative for postmenopausal osteoporosis.Women's health (London, England), , Volume: 11, Issue:6, 2015
Odanacatib for the treatment of postmenopausal osteoporosis: development history and design and participant characteristics of LOFT, the Long-Term Odanacatib Fracture Trial.Osteoporosis international : a journal established as result of cooperation between the European Foundation for Osteoporosis and the National Osteoporosis Foundation of the USA, , Volume: 26, Issue:2, 2015
[Biological therapy for osteoporosis].Clinical calcium, , Volume: 24, Issue:6, 2014
Treatment of postmenopausal osteoporosis with odanacatib.Expert opinion on pharmacotherapy, , Volume: 15, Issue:4, 2014
Effect of the cathepsin K inhibitor odanacatib administered once weekly on bone mineral density in Japanese patients with osteoporosis--a double-blind, randomized, dose-finding study.Osteoporosis international : a journal established as result of cooperation between the European Foundation for Osteoporosis and the National Osteoporosis Foundation of the USA, , Volume: 25, Issue:1, 2014
Odanacatib does not influence the single dose pharmacokinetics and pharmacodynamics of warfarin.Journal of population therapeutics and clinical pharmacology = Journal de la therapeutique des populations et de la pharmacologie clinique, , Volume: 20, Issue:3, 2013
Effects of odanacatib on BMD and safety in the treatment of osteoporosis in postmenopausal women previously treated with alendronate: a randomized placebo-controlled trial.The Journal of clinical endocrinology and metabolism, , Volume: 98, Issue:12, 2013
Bone density, turnover, and estimated strength in postmenopausal women treated with odanacatib: a randomized trial.The Journal of clinical endocrinology and metabolism, , Volume: 98, Issue:2, 2013
Potential role of odanacatib in the treatment of osteoporosis.Clinical interventions in aging, , Volume: 7, 2012
Inhibition of cathepsin K for treatment of osteoporosis.Current osteoporosis reports, , Volume: 10, Issue:1, 2012
[Innovations in the treatment of osteoporosis].Deutsche medizinische Wochenschrift (1946), , Volume: 136, Issue:48, 2011
Discontinuation of odanacatib and other osteoporosis treatments: here today and gone tomorrow?Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 26, Issue:2, 2011
Osteoporosis: now and the future.Lancet (London, England), , Apr-09, Volume: 377, Issue:9773, 2011
[Cathepsin K inhibitor: new therapy approach against osteoporosis. Pharmacological target in the osteoclast].MMW Fortschritte der Medizin, , May-12, Volume: 153, Issue:19, 2011
Odanacatib in the treatment of postmenopausal women with low bone mineral density: three-year continued therapy and resolution of effect.Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 26, Issue:2, 2011
New targets for intervention in the treatment of postmenopausal osteoporosis.Nature reviews. Rheumatology, , Sep-20, Volume: 7, Issue:11, 2011
Peptidomimetic inhibitors of cathepsin K.Current topics in medicinal chemistry, , Volume: 10, Issue:7, 2010
Odanacatib, a cathepsin-K inhibitor for osteoporosis: a two-year study in postmenopausal women with low bone density.Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 25, Issue:5, 2010
Effect of the cathepsin K inhibitor odanacatib on bone resorption biomarkers in healthy postmenopausal women: two double-blind, randomized, placebo-controlled phase I studies.Clinical pharmacology and therapeutics, , Volume: 86, Issue:2, 2009
Odanacatib, a cathepsin K inhibitor for the treatment of osteoporosis and other skeletal disorders associated with excessive bone remodeling.IDrugs : the investigational drugs journal, , Volume: 12, Issue:12, 2009
Molecule of the month. Odanacatib.Drug news & perspectives, , Volume: 21, Issue:5, 2008
The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K.Bioorganic & medicinal chemistry letters, , Feb-01, Volume: 18, Issue:3, 2008
Odanacatib for the treatment of postmenopausal osteoporosis: results of the LOFT multicentre, randomised, double-blind, placebo-controlled trial and LOFT Extension study.The lancet. Diabetes & endocrinology, , Volume: 7, Issue:12, 2019
Multiple vertebral fractures following osteoporosis treatment discontinuation: a case-report after long-term Odanacatib.Osteoporosis international : a journal established as result of cooperation between the European Foundation for Osteoporosis and the National Osteoporosis Foundation of the USA, , Volume: 29, Issue:4, 2018
Efficacy and safety of odanacatib for osteoporosis treatment: a systematic review and meta-analysis.Archives of osteoporosis, , 05-11, Volume: 18, Issue:1, 2023
Odanacatib for the treatment of postmenopausal osteoporosis: results of the LOFT multicentre, randomised, double-blind, placebo-controlled trial and LOFT Extension study.The lancet. Diabetes & endocrinology, , Volume: 7, Issue:12, 2019
Odanacatib for the treatment of osteoporosis.Expert opinion on pharmacotherapy, , Volume: 16, Issue:11, 2015
Effect of odanacatib on BMD and fractures: estimates from Bayesian univariate and bivariate meta-analyses.The Journal of clinical endocrinology and metabolism, , Volume: 99, Issue:9, 2014
Potential first-in-class osteoporosis drug speeds through trials.Nature medicine, , Volume: 18, Issue:8, 2012
Discontinuation of odanacatib and other osteoporosis treatments: here today and gone tomorrow?Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 26, Issue:2, 2011
Odanacatib for the treatment of postmenopausal osteoporosis: results of the LOFT multicentre, randomised, double-blind, placebo-controlled trial and LOFT Extension study.The lancet. Diabetes & endocrinology, , Volume: 7, Issue:12, 2019
Multiple vertebral fractures following osteoporosis treatment discontinuation: a case-report after long-term Odanacatib.Osteoporosis international : a journal established as result of cooperation between the European Foundation for Osteoporosis and the National Osteoporosis Foundation of the USA, , Volume: 29, Issue:4, 2018
The quest for new drugs to prevent osteoporosis-related fractures.Climacteric : the journal of the International Menopause Society, , Volume: 20, Issue:2, 2017
Novel advances in the treatment of osteoporosis.British medical bulletin, , Volume: 119, Issue:1, 2016
Pharmacological inhibition of cathepsin K: A promising novel approach for postmenopausal osteoporosis therapy.Biochemical pharmacology, , 10-01, Volume: 117, 2016
Short-term and long-term effects of osteoporosis therapies.Nature reviews. Endocrinology, , Volume: 11, Issue:7, 2015
Cathepsin K inhibitors: emerging treatment options for osteoporosis.Wiener medizinische Wochenschrift (1946), , Volume: 165, Issue:3-4, 2015
Odanacatib for the treatment of postmenopausal osteoporosis: development history and design and participant characteristics of LOFT, the Long-Term Odanacatib Fracture Trial.Osteoporosis international : a journal established as result of cooperation between the European Foundation for Osteoporosis and the National Osteoporosis Foundation of the USA, , Volume: 26, Issue:2, 2015
[Drug treatment of osteoporosis].Deutsche medizinische Wochenschrift (1946), , Volume: 139, Issue:10, 2014
Effect of the cathepsin K inhibitor odanacatib administered once weekly on bone mineral density in Japanese patients with osteoporosis--a double-blind, randomized, dose-finding study.Osteoporosis international : a journal established as result of cooperation between the European Foundation for Osteoporosis and the National Osteoporosis Foundation of the USA, , Volume: 25, Issue:1, 2014
Osteoporosis: now and the future.Lancet (London, England), , Apr-09, Volume: 377, Issue:9773, 2011
[Innovations in the treatment of osteoporosis].Deutsche medizinische Wochenschrift (1946), , Volume: 136, Issue:48, 2011
Efficacy and safety of odanacatib for osteoporosis treatment: a systematic review and meta-analysis.Archives of osteoporosis, , 05-11, Volume: 18, Issue:1, 2023
Odanacatib for the treatment of postmenopausal osteoporosis: results of the LOFT multicentre, randomised, double-blind, placebo-controlled trial and LOFT Extension study.The lancet. Diabetes & endocrinology, , Volume: 7, Issue:12, 2019
Odanacatib for the treatment of osteoporosis.Expert opinion on pharmacotherapy, , Volume: 16, Issue:11, 2015
Effect of odanacatib on BMD and fractures: estimates from Bayesian univariate and bivariate meta-analyses.The Journal of clinical endocrinology and metabolism, , Volume: 99, Issue:9, 2014
Potential first-in-class osteoporosis drug speeds through trials.Nature medicine, , Volume: 18, Issue:8, 2012
Discontinuation of odanacatib and other osteoporosis treatments: here today and gone tomorrow?Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 26, Issue:2, 2011
Odanacatib Restores Trabecular Bone of Skeletally Mature Female Rabbits With Osteopenia but Induces Brittleness of Cortical Bone: A Comparative Study of the Investigational Drug With PTH, Estrogen, and Alendronate.Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 31, Issue:3, 2016
Odanacatib, effects of 16-month treatment and discontinuation of therapy on bone mass, turnover and strength in the ovariectomized rabbit model of osteopenia.Bone, , Volume: 93, 2016
Cathepsin K inhibitors prevent bone loss in estrogen-deficient rabbits.Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 26, Issue:2, 2011
Bone metastases: molecular mechanisms and novel therapeutic interventions.Medicinal research reviews, , Volume: 32, Issue:3, 2012
New approaches to treating and preventing bone metastases.Current opinion in supportive and palliative care, , Volume: 4, Issue:3, 2010
The cathepsin K inhibitor odanacatib suppresses bone resorption in women with breast cancer and established bone metastases: results of a 4-week, double-blind, randomized, controlled trial.Clinical breast cancer, , Dec-01, Volume: 10, Issue:6, 2010
Odanacatib, a cathepsin K inhibitor for the treatment of osteoporosis and other skeletal disorders associated with excessive bone remodeling.IDrugs : the investigational drugs journal, , Volume: 12, Issue:12, 2009
Cathepsin K inhibitors as treatment of bone metastasis.Current opinion in supportive and palliative care, , Volume: 2, Issue:3, 2008
Effects of odanacatib on bone-turnover markers in osteoporotic postmenopausal women: a post hoc analysis of the LOFT study.Osteoporosis international : a journal established as result of cooperation between the European Foundation for Osteoporosis and the National Osteoporosis Foundation of the USA, , Volume: 33, Issue:10, 2022
Discovery of selective covalent cathepsin K inhibitors containing novel 4-cyanopyrimidine warhead based on quantum chemical calculations and binding mode analysis.Bioorganic & medicinal chemistry, , Nov-15, Volume: 74, 2022
A Mild Inhibition of Cathepsin K Paradoxically Stimulates the Resorptive Activity of Osteoclasts in Culture.Calcified tissue international, , Volume: 104, Issue:1, 2019
Effects of Long-Term Odanacatib Treatment on Bone Gene Expression in Ovariectomized Adult Rhesus Monkeys: Differentiation From Alendronate.Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 31, Issue:4, 2016
Therapeutic implications of suppressing osteoclast formation versus function.Rheumatology (Oxford, England), , Volume: 55, Issue:suppl 2, 2016
A novel approach to inhibit bone resorption: exosite inhibitors against cathepsin K.British journal of pharmacology, , Volume: 173, Issue:2, 2016
Osteoporosis therapy: a novel insight from natural homeostatic system in the skeleton.Osteoporosis international : a journal established as result of cooperation between the European Foundation for Osteoporosis and the National Osteoporosis Foundation of the USA, , Volume: 26, Issue:2, 2015
Pharmacological diversity among drugs that inhibit bone resorption.Current opinion in pharmacology, , Volume: 22, 2015
[Cathepsin K antagonists: preclinical and clinical data].Wiener medizinische Wochenschrift (1946), , Volume: 165, Issue:3-4, 2015
Odanacatib for the treatment of osteoporosis.Expert opinion on pharmacotherapy, , Volume: 16, Issue:11, 2015
Molecular and cellular basis of bone resorption.Wiener medizinische Wochenschrift (1946), , Volume: 165, Issue:3-4, 2015
Inhibition of bone resorption by the cathepsin K inhibitor odanacatib is fully reversible.Bone, , Volume: 67, 2014
[Reducing bone resorption by cathepsin K inhibitor and treatment of osteoporosis].Clinical calcium, , Volume: 24, Issue:1, 2014
The bone resorption inhibitors odanacatib and alendronate affect post-osteoclastic events differently in ovariectomized rabbits.Calcified tissue international, , Volume: 94, Issue:2, 2014
Odanacatib, a selective cathepsin K inhibitor to treat osteoporosis: safety, tolerability, pharmacokinetics and pharmacodynamics--results from single oral dose studies in healthy volunteers.British journal of clinical pharmacology, , Volume: 75, Issue:5, 2013
Inhibition of cathepsin K for treatment of osteoporosis.Current osteoporosis reports, , Volume: 10, Issue:1, 2012
[Odanacatib (MK-0822)].Clinical calcium, , Volume: 21, Issue:1, 2011
Osteoporosis: now and the future.Lancet (London, England), , Apr-09, Volume: 377, Issue:9773, 2011
Cathepsin K inhibitors prevent bone loss in estrogen-deficient rabbits.Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 26, Issue:2, 2011
Odanacatib in the treatment of postmenopausal women with low bone mineral density: three-year continued therapy and resolution of effect.Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 26, Issue:2, 2011
The effects of the cathepsin K inhibitor odanacatib on osteoclastic bone resorption and vesicular trafficking.Bone, , Volume: 49, Issue:4, 2011
The cathepsin K inhibitor odanacatib suppresses bone resorption in women with breast cancer and established bone metastases: results of a 4-week, double-blind, randomized, controlled trial.Clinical breast cancer, , Dec-01, Volume: 10, Issue:6, 2010
Exploiting new targets for old bones.Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 25, Issue:5, 2010
The resorptive apparatus of osteoclasts supports lysosomotropism and increases potency of basic versus non-basic inhibitors of cathepsin K.Bone, , Volume: 46, Issue:5, 2010
Emerging targets in osteoporosis disease modification.Journal of medicinal chemistry, , Jun-10, Volume: 53, Issue:11, 2010
Effect of the cathepsin K inhibitor odanacatib on bone resorption biomarkers in healthy postmenopausal women: two double-blind, randomized, placebo-controlled phase I studies.Clinical pharmacology and therapeutics, , Volume: 86, Issue:2, 2009
Cathepsin K inhibitors as treatment of bone metastasis.Current opinion in supportive and palliative care, , Volume: 2, Issue:3, 2008
Inhibitory effect of cathepsin K inhibitor (ODN-MK-0822) on invasion, migration and adhesion of human breast cancer cells in vitro.Molecular biology reports, , Volume: 48, Issue:1, 2021
Inhibitory Effects of Cathepsin K Inhibitor (ODN-MK-0822) on the Paracrine Pro-Osteoclast Factors of Breast Cancer Cells.Current molecular pharmacology, , Volume: 14, Issue:6, 2021
Bone metastases: molecular mechanisms and novel therapeutic interventions.Medicinal research reviews, , Volume: 32, Issue:3, 2012
The cathepsin K inhibitor odanacatib suppresses bone resorption in women with breast cancer and established bone metastases: results of a 4-week, double-blind, randomized, controlled trial.Clinical breast cancer, , Dec-01, Volume: 10, Issue:6, 2010
Cathepsin K inhibitors as treatment of bone metastasis.Current opinion in supportive and palliative care, , Volume: 2, Issue:3, 2008
Therapeutic candidates for the Zika virus identified by a high-throughput screen for Zika protease inhibitors.Proceedings of the National Academy of Sciences of the United States of America, , 12-08, Volume: 117, Issue:49, 2020
Exploration of effect of Odanacatib on inhibiting orthodontic recurrence in rats and on CatK and IGF-1 mRNA.European review for medical and pharmacological sciences, , Volume: 23, Issue:8, 2019
Odanacatib, effects of 16-month treatment and discontinuation of therapy on bone mass, turnover and strength in the ovariectomized rabbit model of osteopenia.Bone, , Volume: 93, 2016
A small molecule, odanacatib, inhibits inflammation and bone loss caused by endodontic disease.Infection and immunity, , Volume: 83, Issue:4, 2015
Odanacatib, A Cathepsin K-Specific Inhibitor, Inhibits Inflammation and Bone Loss Caused by Periodontal Diseases.Journal of periodontology, , Volume: 86, Issue:8, 2015
Evaluation of high-resolution peripheral quantitative computed tomography, finite element analysis and biomechanical testing in a pre-clinical model of osteoporosis: a study with odanacatib treatment in the ovariectomized adult rhesus monkey.Bone, , Volume: 50, Issue:6, 2012
Potential role of odanacatib in the treatment of osteoporosis.Clinical interventions in aging, , Volume: 7, 2012
Diabetes Mellitus and the Benefit of Antiresorptive Therapy on Fracture Risk.Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 37, Issue:11, 2022
Incidence of Hip and Subtrochanteric/Femoral Shaft Fractures in Postmenopausal Women With Osteoporosis in the Phase 3 Long-Term Odanacatib Fracture Trial.Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 36, Issue:7, 2021
Odanacatib for the treatment of postmenopausal osteoporosis: results of the LOFT multicentre, randomised, double-blind, placebo-controlled trial and LOFT Extension study.The lancet. Diabetes & endocrinology, , Volume: 7, Issue:12, 2019
(1R,2R)-N-(1-cyanocyclopropyl)-2-(6-methoxy-1,3,4,5-tetrahydropyrido[4,3-b]indole-2-carbonyl)cyclohexanecarboxamide (AZD4996): a potent and highly selective cathepsin K inhibitor for the treatment of osteoarthritis.Journal of medicinal chemistry, , Jul-26, Volume: 55, Issue:14, 2012
Efficacy and safety of odanacatib for osteoporosis treatment: a systematic review and meta-analysis.Archives of osteoporosis, , 05-11, Volume: 18, Issue:1, 2023
Diabetes Mellitus and the Benefit of Antiresorptive Therapy on Fracture Risk.Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 37, Issue:11, 2022
Randomized, controlled trial to assess the safety and efficacy of odanacatib in the treatment of men with osteoporosis.Osteoporosis international : a journal established as result of cooperation between the European Foundation for Osteoporosis and the National Osteoporosis Foundation of the USA, , Volume: 32, Issue:1, 2021
Incidence of Hip and Subtrochanteric/Femoral Shaft Fractures in Postmenopausal Women With Osteoporosis in the Phase 3 Long-Term Odanacatib Fracture Trial.Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 36, Issue:7, 2021
Effects of Odanacatib on Bone Structure and Quality in Postmenopausal Women With Osteoporosis: 5-Year Data From the Phase 3 Long-Term Odanacatib Fracture Trial (LOFT) and its Extension.Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 35, Issue:7, 2020
A Mild Inhibition of Cathepsin K Paradoxically Stimulates the Resorptive Activity of Osteoclasts in Culture.Calcified tissue international, , Volume: 104, Issue:1, 2019
Clinical and translational pharmacology of the cathepsin K inhibitor odanacatib studied for osteoporosis.British journal of clinical pharmacology, , Volume: 85, Issue:6, 2019
The quest for new drugs to prevent osteoporosis-related fractures.Climacteric : the journal of the International Menopause Society, , Volume: 20, Issue:2, 2017
Cathepsin K Inhibition: A New Mechanism for the Treatment of Osteoporosis.Calcified tissue international, , Volume: 98, Issue:4, 2016
Odanacatib Restores Trabecular Bone of Skeletally Mature Female Rabbits With Osteopenia but Induces Brittleness of Cortical Bone: A Comparative Study of the Investigational Drug With PTH, Estrogen, and Alendronate.Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 31, Issue:3, 2016
Two pioneering osteoporosis drugs finally approach approval.Nature reviews. Drug discovery, , Jun-30, Volume: 15, Issue:7, 2016
Novel advances in the treatment of osteoporosis.British medical bulletin, , Volume: 119, Issue:1, 2016
Merck &Co. drops osteoporosis drug odanacatib.Nature reviews. Drug discovery, , Sep-29, Volume: 15, Issue:10, 2016
Efficacy and safety of odanacatib treatment for patients with osteoporosis: a meta-analysis.Journal of bone and mineral metabolism, , Volume: 33, Issue:4, 2015
From Bone Cell Biology to Novel Therapies of Osteoporosis.Drug research, , Volume: 65 Suppl 1, 2015
[Osteoporosis].Revue medicale suisse, , Jan-14, Volume: 11, Issue:456-457, 2015
Osteoporosis therapy: a novel insight from natural homeostatic system in the skeleton.Osteoporosis international : a journal established as result of cooperation between the European Foundation for Osteoporosis and the National Osteoporosis Foundation of the USA, , Volume: 26, Issue:2, 2015
Odanacatib for the treatment of osteoporosis.Expert opinion on pharmacotherapy, , Volume: 16, Issue:11, 2015
Short-term and long-term effects of osteoporosis therapies.Nature reviews. Endocrinology, , Volume: 11, Issue:7, 2015
Molecular and cellular basis of bone resorption.Wiener medizinische Wochenschrift (1946), , Volume: 165, Issue:3-4, 2015
[Novel strategies for the development of anabolic agents for treatment of osteoporosis].Nihon yakurigaku zasshi. Folia pharmacologica Japonica, , Volume: 144, Issue:6, 2014
Effect of odanacatib on BMD and fractures: estimates from Bayesian univariate and bivariate meta-analyses.The Journal of clinical endocrinology and metabolism, , Volume: 99, Issue:9, 2014
New therapeutics for osteoporosis.Current opinion in pharmacology, , Volume: 16, 2014
Effect of the cathepsin K inhibitor odanacatib administered once weekly on bone mineral density in Japanese patients with osteoporosis--a double-blind, randomized, dose-finding study.Osteoporosis international : a journal established as result of cooperation between the European Foundation for Osteoporosis and the National Osteoporosis Foundation of the USA, , Volume: 25, Issue:1, 2014
[Drug treatment of osteoporosis].Deutsche medizinische Wochenschrift (1946), , Volume: 139, Issue:10, 2014
Current and future treatments of osteoporosis in men.Best practice & research. Clinical endocrinology & metabolism, , Volume: 28, Issue:6, 2014
Status of drug development for the prevention and treatment of osteoporosis.Expert opinion on drug discovery, , Volume: 9, Issue:3, 2014
Implications of osteoblast-osteoclast interactions in the management of osteoporosis by antiresorptive agents denosumab and odanacatib.Current osteoporosis reports, , Volume: 12, Issue:1, 2014
Future directions for new medical entities in osteoporosis.Best practice & research. Clinical endocrinology & metabolism, , Volume: 28, Issue:6, 2014
[Reducing bone resorption by cathepsin K inhibitor and treatment of osteoporosis].Clinical calcium, , Volume: 24, Issue:1, 2014
On the horizon: better bone-building drugs?Mayo Clinic health letter (English ed.), , Volume: 32, Issue:12, 2014
Odanacatib, a selective cathepsin K inhibitor to treat osteoporosis: safety, tolerability, pharmacokinetics and pharmacodynamics--results from single oral dose studies in healthy volunteers.British journal of clinical pharmacology, , Volume: 75, Issue:5, 2013
Potential first-in-class osteoporosis drug speeds through trials.Nature medicine, , Volume: 18, Issue:8, 2012
Inhibition of cathepsin K for treatment of osteoporosis.Current osteoporosis reports, , Volume: 10, Issue:1, 2012
Evaluation of high-resolution peripheral quantitative computed tomography, finite element analysis and biomechanical testing in a pre-clinical model of osteoporosis: a study with odanacatib treatment in the ovariectomized adult rhesus monkey.Bone, , Volume: 50, Issue:6, 2012
[Odanacatib (MK-0822)].Clinical calcium, , Volume: 21, Issue:1, 2011
[Innovations in the treatment of osteoporosis].Deutsche medizinische Wochenschrift (1946), , Volume: 136, Issue:48, 2011
Discontinuation of odanacatib and other osteoporosis treatments: here today and gone tomorrow?Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 26, Issue:2, 2011
Osteoporosis: now and the future.Lancet (London, England), , Apr-09, Volume: 377, Issue:9773, 2011
Emerging targets in osteoporosis disease modification.Journal of medicinal chemistry, , Jun-10, Volume: 53, Issue:11, 2010
Investigation of ketone warheads as alternatives to the nitrile for preparation of potent and selective cathepsin K inhibitors.Bioorganic & medicinal chemistry letters, , Feb-01, Volume: 19, Issue:3, 2009
[Bone remodeling: new therapeutic approaches].Revue medicale suisse, , Jun-10, Volume: 5, Issue:207, 2009
Efficacy and safety of odanacatib for osteoporosis treatment: a systematic review and meta-analysis.Archives of osteoporosis, , 05-11, Volume: 18, Issue:1, 2023
Effects of odanacatib on bone-turnover markers in osteoporotic postmenopausal women: a post hoc analysis of the LOFT study.Osteoporosis international : a journal established as result of cooperation between the European Foundation for Osteoporosis and the National Osteoporosis Foundation of the USA, , Volume: 33, Issue:10, 2022
Morphea-like skin lesions reported in the phase 3 Long-Term Odanacatib Fracture Trial (LOFT) in postmenopausal women with osteoporosis.Journal of the American Academy of Dermatology, , Volume: 84, Issue:4, 2021
Incidence of Hip and Subtrochanteric/Femoral Shaft Fractures in Postmenopausal Women With Osteoporosis in the Phase 3 Long-Term Odanacatib Fracture Trial.Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 36, Issue:7, 2021
Population Pharmacokinetic Analysis of the Cathepsin K Inhibitor Odanacatib: Insights Into Intrinsic and Extrinsic Factor Effects on Exposure in Postmenopausal and Elderly Women.Journal of clinical pharmacology, , Volume: 60, Issue:8, 2020
Effects of Odanacatib on Bone Structure and Quality in Postmenopausal Women With Osteoporosis: 5-Year Data From the Phase 3 Long-Term Odanacatib Fracture Trial (LOFT) and its Extension.Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 35, Issue:7, 2020
Odanacatib for the treatment of postmenopausal osteoporosis: results of the LOFT multicentre, randomised, double-blind, placebo-controlled trial and LOFT Extension study.The lancet. Diabetes & endocrinology, , Volume: 7, Issue:12, 2019
Odanacatib: the best osteoporosis treatment we never had?The lancet. Diabetes & endocrinology, , Volume: 7, Issue:12, 2019
Treatment with zoledronic acid subsequent to odanacatib prevents bone loss in postmenopausal women with osteoporosis.Osteoporosis international : a journal established as result of cooperation between the European Foundation for Osteoporosis and the National Osteoporosis Foundation of the USA, , Volume: 30, Issue:5, 2019
Multiple vertebral fractures following osteoporosis treatment discontinuation: a case-report after long-term Odanacatib.Osteoporosis international : a journal established as result of cooperation between the European Foundation for Osteoporosis and the National Osteoporosis Foundation of the USA, , Volume: 29, Issue:4, 2018
Continuous treatment with odanacatib for up to 8 years in postmenopausal women with low bone mineral density: a phase 2 study.Osteoporosis international : a journal established as result of cooperation between the European Foundation for Osteoporosis and the National Osteoporosis Foundation of the USA, , Volume: 27, Issue:6, 2016
Pharmacological inhibition of cathepsin K: A promising novel approach for postmenopausal osteoporosis therapy.Biochemical pharmacology, , 10-01, Volume: 117, 2016
Cathepsin K inhibitors: emerging treatment options for osteoporosis.Wiener medizinische Wochenschrift (1946), , Volume: 165, Issue:3-4, 2015
[Cathepsin K antagonists: preclinical and clinical data].Wiener medizinische Wochenschrift (1946), , Volume: 165, Issue:3-4, 2015
Odanacatib: an emerging novel treatment alternative for postmenopausal osteoporosis.Women's health (London, England), , Volume: 11, Issue:6, 2015
Odanacatib for the treatment of postmenopausal osteoporosis: development history and design and participant characteristics of LOFT, the Long-Term Odanacatib Fracture Trial.Osteoporosis international : a journal established as result of cooperation between the European Foundation for Osteoporosis and the National Osteoporosis Foundation of the USA, , Volume: 26, Issue:2, 2015
[Biological therapy for osteoporosis].Clinical calcium, , Volume: 24, Issue:6, 2014
Effect of the cathepsin K inhibitor odanacatib administered once weekly on bone mineral density in Japanese patients with osteoporosis--a double-blind, randomized, dose-finding study.Osteoporosis international : a journal established as result of cooperation between the European Foundation for Osteoporosis and the National Osteoporosis Foundation of the USA, , Volume: 25, Issue:1, 2014
Treatment of postmenopausal osteoporosis with odanacatib.Expert opinion on pharmacotherapy, , Volume: 15, Issue:4, 2014
Bone density, turnover, and estimated strength in postmenopausal women treated with odanacatib: a randomized trial.The Journal of clinical endocrinology and metabolism, , Volume: 98, Issue:2, 2013
Effects of odanacatib on BMD and safety in the treatment of osteoporosis in postmenopausal women previously treated with alendronate: a randomized placebo-controlled trial.The Journal of clinical endocrinology and metabolism, , Volume: 98, Issue:12, 2013
Odanacatib does not influence the single dose pharmacokinetics and pharmacodynamics of warfarin.Journal of population therapeutics and clinical pharmacology = Journal de la therapeutique des populations et de la pharmacologie clinique, , Volume: 20, Issue:3, 2013
Potential role of odanacatib in the treatment of osteoporosis.Clinical interventions in aging, , Volume: 7, 2012
Inhibition of cathepsin K for treatment of osteoporosis.Current osteoporosis reports, , Volume: 10, Issue:1, 2012
New targets for intervention in the treatment of postmenopausal osteoporosis.Nature reviews. Rheumatology, , Sep-20, Volume: 7, Issue:11, 2011
[Cathepsin K inhibitor: new therapy approach against osteoporosis. Pharmacological target in the osteoclast].MMW Fortschritte der Medizin, , May-12, Volume: 153, Issue:19, 2011
Osteoporosis: now and the future.Lancet (London, England), , Apr-09, Volume: 377, Issue:9773, 2011
Discontinuation of odanacatib and other osteoporosis treatments: here today and gone tomorrow?Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 26, Issue:2, 2011
[Innovations in the treatment of osteoporosis].Deutsche medizinische Wochenschrift (1946), , Volume: 136, Issue:48, 2011
Odanacatib in the treatment of postmenopausal women with low bone mineral density: three-year continued therapy and resolution of effect.Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 26, Issue:2, 2011
Peptidomimetic inhibitors of cathepsin K.Current topics in medicinal chemistry, , Volume: 10, Issue:7, 2010
Odanacatib, a cathepsin-K inhibitor for osteoporosis: a two-year study in postmenopausal women with low bone density.Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 25, Issue:5, 2010
Effect of the cathepsin K inhibitor odanacatib on bone resorption biomarkers in healthy postmenopausal women: two double-blind, randomized, placebo-controlled phase I studies.Clinical pharmacology and therapeutics, , Volume: 86, Issue:2, 2009
Odanacatib, a cathepsin K inhibitor for the treatment of osteoporosis and other skeletal disorders associated with excessive bone remodeling.IDrugs : the investigational drugs journal, , Volume: 12, Issue:12, 2009
The discovery of odanacatib (MK-0822), a selective inhibitor of cathepsin K.Bioorganic & medicinal chemistry letters, , Feb-01, Volume: 18, Issue:3, 2008
Molecule of the month. Odanacatib.Drug news & perspectives, , Volume: 21, Issue:5, 2008
Odanacatib for the treatment of postmenopausal osteoporosis: results of the LOFT multicentre, randomised, double-blind, placebo-controlled trial and LOFT Extension study.The lancet. Diabetes & endocrinology, , Volume: 7, Issue:12, 2019
Multiple vertebral fractures following osteoporosis treatment discontinuation: a case-report after long-term Odanacatib.Osteoporosis international : a journal established as result of cooperation between the European Foundation for Osteoporosis and the National Osteoporosis Foundation of the USA, , Volume: 29, Issue:4, 2018
Odanacatib, A Cathepsin K-Specific Inhibitor, Inhibits Inflammation and Bone Loss Caused by Periodontal Diseases.Journal of periodontology, , Volume: 86, Issue:8, 2015
Effect of odanacatib on root resorption and alveolar bone metabolism during orthodontic tooth movement.Genetics and molecular research : GMR, , Dec-22, Volume: 14, Issue:4, 2015
A small molecule, odanacatib, inhibits inflammation and bone loss caused by endodontic disease.Infection and immunity, , Volume: 83, Issue:4, 2015
Safety/Toxicity (6)
Article | Year |
Efficacy and safety of odanacatib for osteoporosis treatment: a systematic review and meta-analysis. Archives of osteoporosis, , 05-11, Volume: 18, Issue:1 | 2023 |
Randomized, controlled trial to assess the safety and efficacy of odanacatib in the treatment of men with osteoporosis. Osteoporosis international : a journal established as result of cooperation between the European Foundation for Osteoporosis and the National Osteoporosis Foundation of the USA, , Volume: 32, Issue:1 | 2021 |
Thorough QTc Evaluation and the Safety of Supratherapeutic Doses of Odanacatib in Healthy Subjects. Clinical pharmacology in drug development, , Volume: 8, Issue:7 | 2019 |
Efficacy and safety of odanacatib treatment for patients with osteoporosis: a meta-analysis. Journal of bone and mineral metabolism, , Volume: 33, Issue:4 | 2015 |
Effects of odanacatib on BMD and safety in the treatment of osteoporosis in postmenopausal women previously treated with alendronate: a randomized placebo-controlled trial. The Journal of clinical endocrinology and metabolism, , Volume: 98, Issue:12 | 2013 |
Odanacatib, a selective cathepsin K inhibitor to treat osteoporosis: safety, tolerability, pharmacokinetics and pharmacodynamics--results from single oral dose studies in healthy volunteers. British journal of clinical pharmacology, , Volume: 75, Issue:5 | 2013 |
Long-term Use (3)
Pharmacokinetics (9)
Article | Year |
Population Pharmacokinetic Analysis of the Cathepsin K Inhibitor Odanacatib: Insights Into Intrinsic and Extrinsic Factor Effects on Exposure in Postmenopausal and Elderly Women. Journal of clinical pharmacology, , Volume: 60, Issue:8 | 2020 |
The Absolute Bioavailability and Effect of Food on the Pharmacokinetics of Odanacatib: A Stable-Label i.v./Oral Study in Healthy Postmenopausal Women. Drug metabolism and disposition: the biological fate of chemicals, , Volume: 44, Issue:9 | 2016 |
Development and validation of an RP-HPLC method for the quantitation of odanacatib in rat and human plasma and its application to a pharmacokinetic study. Biomedical chromatography : BMC, , Volume: 29, Issue:11 | 2015 |
Prednisone has no effect on the pharmacokinetics of CYP3A4 metabolized drugs - midazolam and odanacatib. Journal of clinical pharmacology, , Volume: 54, Issue:11 | 2014 |
Odanacatib, a selective cathepsin K inhibitor, demonstrates comparable pharmacodynamics and pharmacokinetics in older men and postmenopausal women. The Journal of clinical endocrinology and metabolism, , Volume: 99, Issue:2 | 2014 |
Odanacatib does not influence the single dose pharmacokinetics and pharmacodynamics of warfarin. Journal of population therapeutics and clinical pharmacology = Journal de la therapeutique des populations et de la pharmacologie clinique, , Volume: 20, Issue:3 | 2013 |
Odanacatib, a selective cathepsin K inhibitor to treat osteoporosis: safety, tolerability, pharmacokinetics and pharmacodynamics--results from single oral dose studies in healthy volunteers. British journal of clinical pharmacology, , Volume: 75, Issue:5 | 2013 |
Pharmacokinetic benefits of 3,4-dimethoxy substitution of a phenyl ring and design of isosteres yielding orally available cathepsin K inhibitors. Journal of medicinal chemistry, , Oct-25, Volume: 55, Issue:20 | 2012 |
Pharmacokinetics and metabolism in rats, dogs, and monkeys of the cathepsin k inhibitor odanacatib: demethylation of a methylsulfonyl moiety as a major metabolic pathway. Drug metabolism and disposition: the biological fate of chemicals, , Volume: 39, Issue:6 | 2011 |
Bioavailability (9)
Article | Year |
Population Pharmacokinetic Analysis of the Cathepsin K Inhibitor Odanacatib: Insights Into Intrinsic and Extrinsic Factor Effects on Exposure in Postmenopausal and Elderly Women. Journal of clinical pharmacology, , Volume: 60, Issue:8 | 2020 |
A High-Throughput Screen of a Library of Therapeutics Identifies Cytotoxic Substrates of P-glycoprotein. Molecular pharmacology, , Volume: 96, Issue:5 | 2019 |
The Absolute Bioavailability and Effect of Food on the Pharmacokinetics of Odanacatib: A Stable-Label i.v./Oral Study in Healthy Postmenopausal Women. Drug metabolism and disposition: the biological fate of chemicals, , Volume: 44, Issue:9 | 2016 |
Disposition and metabolism of the cathepsin K inhibitor odanacatib in humans. Drug metabolism and disposition: the biological fate of chemicals, , Volume: 42, Issue:5 | 2014 |
Potential role of odanacatib in the treatment of osteoporosis. Clinical interventions in aging, , Volume: 7 | 2012 |
Pharmacokinetics and metabolism in rats, dogs, and monkeys of the cathepsin k inhibitor odanacatib: demethylation of a methylsulfonyl moiety as a major metabolic pathway. Drug metabolism and disposition: the biological fate of chemicals, , Volume: 39, Issue:6 | 2011 |
Difluoroethylamines as an amide isostere in inhibitors of cathepsin K. Bioorganic & medicinal chemistry letters, , Feb-01, Volume: 21, Issue:3 | 2011 |
Peptidomimetic inhibitors of cathepsin K. Current topics in medicinal chemistry, , Volume: 10, Issue:7 | 2010 |
The discovery of MK-0674, an orally bioavailable cathepsin K inhibitor. Bioorganic & medicinal chemistry letters, , Feb-01, Volume: 20, Issue:3 | 2010 |
Dosage (8)
Article | Year |
Thorough QTc Evaluation and the Safety of Supratherapeutic Doses of Odanacatib in Healthy Subjects. Clinical pharmacology in drug development, , Volume: 8, Issue:7 | 2019 |
Clinical and translational pharmacology of the cathepsin K inhibitor odanacatib studied for osteoporosis. British journal of clinical pharmacology, , Volume: 85, Issue:6 | 2019 |
Cathepsin K Inhibition: A New Mechanism for the Treatment of Osteoporosis. Calcified tissue international, , Volume: 98, Issue:4 | 2016 |
Cathepsin K inhibitors increase distal femoral bone mineral density in rapidly growing rabbits. BMC musculoskeletal disorders, , Dec-09, Volume: 14 | 2013 |
High-resolution peripheral quantitative computed tomography and finite element analysis of bone strength at the distal radius in ovariectomized adult rhesus monkey demonstrate efficacy of odanacatib and differentiation from alendronate. Bone, , Volume: 56, Issue:2 | 2013 |
Odanacatib, a selective cathepsin K inhibitor to treat osteoporosis: safety, tolerability, pharmacokinetics and pharmacodynamics--results from single oral dose studies in healthy volunteers. British journal of clinical pharmacology, , Volume: 75, Issue:5 | 2013 |
Cathepsin K inhibitors prevent bone loss in estrogen-deficient rabbits. Journal of bone and mineral research : the official journal of the American Society for Bone and Mineral Research, , Volume: 26, Issue:2 | 2011 |
Effect of the cathepsin K inhibitor odanacatib on bone resorption biomarkers in healthy postmenopausal women: two double-blind, randomized, placebo-controlled phase I studies. Clinical pharmacology and therapeutics, , Volume: 86, Issue:2 | 2009 |
Interactions (1)