ID Source | ID |
---|---|
PubMed CID | 57390074 |
CHEMBL ID | 3397300 |
SCHEMBL ID | 11916416 |
MeSH ID | M000606712 |
Synonym |
---|
bdbm50062357 |
chembl3397300 , |
ap26113 |
SCHEMBL11916416 |
alk-in-1 |
HY-13464 |
CS-1368 |
1197958-12-5 |
S7000 |
(2-((5-chloro-2-((4-(4-(dimethylamino)piperidin-1-yl)-2-methoxyphenyl)amino)pyrimidin-4-yl)amino)phenyl)dimethylphosphine oxide |
c26h34cln6o2p |
5-chloro-2-n-[4-[4-(dimethylamino)piperidin-1-yl]-2-methoxyphenyl]-4-n-(2-dimethylphosphorylphenyl)pyrimidine-2,4-diamine |
unii-3dgd69c6pv |
2,4-pyrimidinediamine, 5-chloro-n2-(4-(4-(dimethylamino)-1-piperidinyl)-2-methoxyphenyl)-n4-(2-(dimethylphosphinyl)phenyl)- |
3DGD69C6PV , |
5-chloro-n2-(4-(4-(dimethylamino)-1-piperidinyl)-2-methoxyphenyl)-n4-(2-(dimethylphosphinyl)phenyl)-2,4-pyrimidinediamine |
AC-27470 |
FT-0696829 |
AKOS025401944 |
DTXSID30725416 |
5-chloro-n2-[4-[4-(dimethylamino)-1-piperidinyl]-2-methoxyphenyl]-n4-[2-(dimethylphosphinyl)phenyl]-2,4-pyrimidinediamine |
EX-A770 |
ap26113;alk-in-1 |
HMS3652H14 |
AS-75104 |
5-chloro-n2-{4-[4-(dimethylamino)piperidin-1-yl]-2-methoxyphenyl}-n4-[2-(dimethylphosphoryl)phenyl]pyrimidine-2,4-diamine |
2,4-pyrimidinediamine, 5-chloro-n2-[4-[4-(dimethylamino)-1-piperidinyl]-2-methoxyphenyl]-n4-[2-(dimethylphosphinyl)phenyl]- |
5-chloro-n2-(4-(4-(dimethylamino)piperidin-1-yl)-2-methoxyphenyl)-n4-(2-(dimethylphosphoryl)phenyl)pyrimidine-2,4-diamine |
mfcd23704187 |
NCGC00351602-09 |
NCGC00351602-05 |
SW219566-1 |
brigatinib(ap26113) |
5-chloro-n~2~-{4-[4-(dimethylamino)piperidin-1-yl]-2-methoxyphenyl}-n~4~-[2-(dimethylphosphoryl)phenyl]pyrimidine-2,4-diamine |
e5j , |
AKOS032949980 |
BCP06648 |
Q4653190 |
SB16487 |
HMS3673I09 |
CCG-264698 |
nsc-800977 |
nsc800977 |
nsc-776763 |
nsc776763 |
NCGC00351602-02 |
Protein | Taxonomy | Measurement | Average (mM) | Bioassay(s) |
---|---|---|---|---|
PPM1D protein | Homo sapiens (human) | Potency | 0.2082 | AID1347411 |
cytochrome P450 family 3 subfamily A polypeptide 4 | Homo sapiens (human) | Potency | 23.9185 | AID1645841 |
G | Vesicular stomatitis virus | Potency | 8.4866 | AID1645842 |
Interferon beta | Homo sapiens (human) | Potency | 2.2778 | AID1347411; AID1645842 |
HLA class I histocompatibility antigen, B alpha chain | Homo sapiens (human) | Potency | 8.4866 | AID1645842 |
Inositol hexakisphosphate kinase 1 | Homo sapiens (human) | Potency | 8.4866 | AID1645842 |
cytochrome P450 2C9, partial | Homo sapiens (human) | Potency | 8.4866 | AID1645842 |
Protein | Taxonomy | Measurement | Average (mM) | Bioassay(s) |
---|---|---|---|---|
Serine/threonine-protein kinase/endoribonuclease IRE1 | Homo sapiens (human) | IC50 | 0.0660 | AID1801919 |
Epidermal growth factor receptor | Homo sapiens (human) | GI50 | 0.0591 | AID1372112 |
Insulin receptor | Homo sapiens (human) | IC50 | 0.1000 | AID1310803 |
Insulin-like growth factor 1 receptor | Homo sapiens (human) | IC50 | 0.0032 | AID1310802 |
Proto-oncogene tyrosine-protein kinase ROS | Homo sapiens (human) | IC50 | 0.0019 | AID1191196 |
Echinoderm microtubule-associated protein-like 4 | Homo sapiens (human) | IC50 | 0.3965 | AID1267028; AID1267029; AID1267030; AID1267031; AID1267032; AID1267034 |
ALK tyrosine kinase receptor | Homo sapiens (human) | IC50 | 0.2975 | AID1191197; AID1267028; AID1267029; AID1267030; AID1267031; AID1267032; AID1267034; AID1310801 |
Protein | Taxonomy | Measurement | Average (mM) | Bioassay(s) |
---|---|---|---|---|
Aurora kinase A | Homo sapiens (human) | Kd | 0.3341 | AID1342794 |
Assay ID | Title | Year | Journal | Article |
---|---|---|---|---|
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. |
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. |
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. |
AID1347160 | Primary screen NINDS Rhodamine 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. |
AID1347159 | Primary screen GU Rhodamine qHTS for Zika virus inhibitors: Unlinked NS2B-NS3 protease assay | 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. |
AID1267031 | Inhibition of EML4-ALK L1196M mutant (unknown origin) expressed in mouse Ba/F3 cells assessed as cell viability after 72 hrs by MTS assay | 2015 | Journal of medicinal chemistry, Dec-10, Volume: 58, Issue:23 ISSN: 1520-4804 | Discovery of Inhibitors That Overcome the G1202R Anaplastic Lymphoma Kinase Resistance Mutation. |
AID1267047 | Antiproliferative activity against human SH-SY5Y cells expressing EML4-ALK F1174L mutant after 72 hrs by CellTiter-Glo Luminescent Cell Viability Assay | 2015 | Journal of medicinal chemistry, Dec-10, Volume: 58, Issue:23 ISSN: 1520-4804 | Discovery of Inhibitors That Overcome the G1202R Anaplastic Lymphoma Kinase Resistance Mutation. |
AID1267028 | Inhibition of wild type EML4-ALK (unknown origin) expressed in mouse Ba/F3 cells assessed as cell viability after 72 hrs by MTS assay | 2015 | Journal of medicinal chemistry, Dec-10, Volume: 58, Issue:23 ISSN: 1520-4804 | Discovery of Inhibitors That Overcome the G1202R Anaplastic Lymphoma Kinase Resistance Mutation. |
AID1267044 | Antiproliferative activity against human DFCI114 cells expressing EML4-ALK G1269A mutant after 72 hrs by CellTiter-Glo Luminescent Cell Viability Assay | 2015 | Journal of medicinal chemistry, Dec-10, Volume: 58, Issue:23 ISSN: 1520-4804 | Discovery of Inhibitors That Overcome the G1202R Anaplastic Lymphoma Kinase Resistance Mutation. |
AID1310805 | Antiproliferative activity against human ALK-negative U937 cells assessed as reduction in cell viability measured after 72 hrs by CellTiter 96 aqueous one solution cell proliferation assay | 2016 | Journal of medicinal chemistry, 05-26, Volume: 59, Issue:10 ISSN: 1520-4804 | Discovery of Brigatinib (AP26113), a Phosphine Oxide-Containing, Potent, Orally Active Inhibitor of Anaplastic Lymphoma Kinase. |
AID1267033 | Inhibition of EML4-ALK 1151Tins mutant (unknown origin) expressed in mouse Ba/F3 cells assessed as cell viability after 72 hrs by MTS assay | 2015 | Journal of medicinal chemistry, Dec-10, Volume: 58, Issue:23 ISSN: 1520-4804 | Discovery of Inhibitors That Overcome the G1202R Anaplastic Lymphoma Kinase Resistance Mutation. |
AID1267043 | Antiproliferative activity against human DFCI76 cells expressing EML4-ALK L1152R mutant after 72 hrs by CellTiter-Glo Luminescent Cell Viability Assay | 2015 | Journal of medicinal chemistry, Dec-10, Volume: 58, Issue:23 ISSN: 1520-4804 | Discovery of Inhibitors That Overcome the G1202R Anaplastic Lymphoma Kinase Resistance Mutation. |
AID1915686 | Cytotoxicity against mouse BaF3 cells expressing human EGFR C797S/del19 mutant assessed as inhibition of in cell viability measured after 72 hrs by CellTiter-Glo assay | 2021 | European journal of medicinal chemistry, Jan-15, Volume: 210ISSN: 1768-3254 | The new opportunities in medicinal chemistry of fourth-generation EGFR inhibitors to overcome C797S mutation. |
AID1267036 | Inhibition of EML4-ALK S1206Y mutant (unknown origin) expressed in mouse Ba/F3 cells assessed as cell viability after 72 hrs by MTS assay | 2015 | Journal of medicinal chemistry, Dec-10, Volume: 58, Issue:23 ISSN: 1520-4804 | Discovery of Inhibitors That Overcome the G1202R Anaplastic Lymphoma Kinase Resistance Mutation. |
AID1267035 | Inhibition of EML4-ALK G1269A mutant (unknown origin) expressed in mouse Ba/F3 cells assessed as cell viability after 72 hrs by MTS assay | 2015 | Journal of medicinal chemistry, Dec-10, Volume: 58, Issue:23 ISSN: 1520-4804 | Discovery of Inhibitors That Overcome the G1202R Anaplastic Lymphoma Kinase Resistance Mutation. |
AID1267034 | Inhibition of EML4-ALK G1202R mutant (unknown origin) expressed in mouse Ba/F3 cells assessed as cell viability after 72 hrs by MTS assay | 2015 | Journal of medicinal chemistry, Dec-10, Volume: 58, Issue:23 ISSN: 1520-4804 | Discovery of Inhibitors That Overcome the G1202R Anaplastic Lymphoma Kinase Resistance Mutation. |
AID1191196 | Inhibition of ROS1 (unknown origin) | 2015 | European journal of medicinal chemistry, Jan-27, Volume: 90ISSN: 1768-3254 | Synthesis and biological evaluation of new pyrazol-4-ylpyrimidine derivatives as potential ROS1 kinase inhibitors. |
AID1372112 | Inhibition of human EGFR del19/T790M/C797S mutant expressed in mouse Ba/F3 cells assessed as cell growth inhibition after 72 hrs by CellTiter-Glo assay | 2018 | Journal of medicinal chemistry, 05-24, Volume: 61, Issue:10 ISSN: 1520-4804 | Recent Progress of Small-Molecule Epidermal Growth Factor Receptor (EGFR) Inhibitors against C797S Resistance in Non-Small-Cell Lung Cancer. |
AID1267045 | Antiproliferative activity against human Kelly cells expressing EML4-ALK F1174L mutant after 72 hrs by CellTiter-Glo Luminescent Cell Viability Assay | 2015 | Journal of medicinal chemistry, Dec-10, Volume: 58, Issue:23 ISSN: 1520-4804 | Discovery of Inhibitors That Overcome the G1202R Anaplastic Lymphoma Kinase Resistance Mutation. |
AID1267052 | Antiproliferative activity against human SK-N-BE(2) cells expressing wild type EML4-ALK after 72 hrs by CellTiter-Glo Luminescent Cell Viability Assay | 2015 | Journal of medicinal chemistry, Dec-10, Volume: 58, Issue:23 ISSN: 1520-4804 | Discovery of Inhibitors That Overcome the G1202R Anaplastic Lymphoma Kinase Resistance Mutation. |
AID1191197 | Inhibition of ALK (unknown origin) | 2015 | European journal of medicinal chemistry, Jan-27, Volume: 90ISSN: 1768-3254 | Synthesis and biological evaluation of new pyrazol-4-ylpyrimidine derivatives as potential ROS1 kinase inhibitors. |
AID1267037 | Cytotoxicity against mouse BA/F3 cells assessed as cell viability after 72 hrs by MTS assay | 2015 | Journal of medicinal chemistry, Dec-10, Volume: 58, Issue:23 ISSN: 1520-4804 | Discovery of Inhibitors That Overcome the G1202R Anaplastic Lymphoma Kinase Resistance Mutation. |
AID1310803 | Inhibition of human InsR using myelin basic protein as substrate and [gamma-33P]ATP measured after 1 hr | 2016 | Journal of medicinal chemistry, 05-26, Volume: 59, Issue:10 ISSN: 1520-4804 | Discovery of Brigatinib (AP26113), a Phosphine Oxide-Containing, Potent, Orally Active Inhibitor of Anaplastic Lymphoma Kinase. |
AID1267054 | Antiproliferative activity against human SK-N-AS cells expressing wild type EML4-ALK after 72 hrs by CellTiter-Glo Luminescent Cell Viability Assay | 2015 | Journal of medicinal chemistry, Dec-10, Volume: 58, Issue:23 ISSN: 1520-4804 | Discovery of Inhibitors That Overcome the G1202R Anaplastic Lymphoma Kinase Resistance Mutation. |
AID1267050 | Antiproliferative activity against human SMS-KCNR cells expressing EML4-ALK R1275Q mutant after 72 hrs by CellTiter-Glo Luminescent Cell Viability Assay | 2015 | Journal of medicinal chemistry, Dec-10, Volume: 58, Issue:23 ISSN: 1520-4804 | Discovery of Inhibitors That Overcome the G1202R Anaplastic Lymphoma Kinase Resistance Mutation. |
AID1267030 | Inhibition of EML4-ALK F1174L mutant (unknown origin) expressed in mouse Ba/F3 cells assessed as cell viability after 72 hrs by MTS assay | 2015 | Journal of medicinal chemistry, Dec-10, Volume: 58, Issue:23 ISSN: 1520-4804 | Discovery of Inhibitors That Overcome the G1202R Anaplastic Lymphoma Kinase Resistance Mutation. |
AID1267048 | Antiproliferative activity against human SK-N-SH cells expressing EML4-ALK F1174L mutant after 72 hrs by CellTiter-Glo Luminescent Cell Viability Assay | 2015 | Journal of medicinal chemistry, Dec-10, Volume: 58, Issue:23 ISSN: 1520-4804 | Discovery of Inhibitors That Overcome the G1202R Anaplastic Lymphoma Kinase Resistance Mutation. |
AID1267049 | Antiproliferative activity against human LAN5 cells expressing EML4-ALK R1275Q mutant after 72 hrs by CellTiter-Glo Luminescent Cell Viability Assay | 2015 | Journal of medicinal chemistry, Dec-10, Volume: 58, Issue:23 ISSN: 1520-4804 | Discovery of Inhibitors That Overcome the G1202R Anaplastic Lymphoma Kinase Resistance Mutation. |
AID1310804 | Antiproliferative activity against human ALK-positive KARPAS299 cells assessed as reduction in cell viability measured after 72 hrs by CellTiter 96 aqueous one solution cell proliferation assay | 2016 | Journal of medicinal chemistry, 05-26, Volume: 59, Issue:10 ISSN: 1520-4804 | Discovery of Brigatinib (AP26113), a Phosphine Oxide-Containing, Potent, Orally Active Inhibitor of Anaplastic Lymphoma Kinase. |
AID1267032 | Inhibition of EML4-ALK L1152R mutant (unknown origin) expressed in mouse Ba/F3 cells assessed as cell viability after 72 hrs by MTS assay | 2015 | Journal of medicinal chemistry, Dec-10, Volume: 58, Issue:23 ISSN: 1520-4804 | Discovery of Inhibitors That Overcome the G1202R Anaplastic Lymphoma Kinase Resistance Mutation. |
AID1267042 | Antiproliferative activity against human NCI-H3122 cells after 72 hrs by CellTiter-Glo Luminescent Cell Viability Assay | 2015 | Journal of medicinal chemistry, Dec-10, Volume: 58, Issue:23 ISSN: 1520-4804 | Discovery of Inhibitors That Overcome the G1202R Anaplastic Lymphoma Kinase Resistance Mutation. |
AID1310802 | Inhibition of human IGF1R using KKKSPGEYVNIEFG as substrate and [gamma-33P]ATP measured after 1 hr | 2016 | Journal of medicinal chemistry, 05-26, Volume: 59, Issue:10 ISSN: 1520-4804 | Discovery of Brigatinib (AP26113), a Phosphine Oxide-Containing, Potent, Orally Active Inhibitor of Anaplastic Lymphoma Kinase. |
AID1267053 | Antiproliferative activity against human SK-N-FI cells expressing wild type EML4-ALK after 72 hrs by CellTiter-Glo Luminescent Cell Viability Assay | 2015 | Journal of medicinal chemistry, Dec-10, Volume: 58, Issue:23 ISSN: 1520-4804 | Discovery of Inhibitors That Overcome the G1202R Anaplastic Lymphoma Kinase Resistance Mutation. |
AID1267029 | Inhibition of EML4-ALK C1156Y mutant (unknown origin) expressed in mouse Ba/F3 cells assessed as cell viability after 72 hrs by MTS assay | 2015 | Journal of medicinal chemistry, Dec-10, Volume: 58, Issue:23 ISSN: 1520-4804 | Discovery of Inhibitors That Overcome the G1202R Anaplastic Lymphoma Kinase Resistance Mutation. |
AID1267051 | Antiproliferative activity against human CHLA20 cells expressing EML4-ALK R1275Q mutant after 72 hrs by CellTiter-Glo Luminescent Cell Viability Assay | 2015 | Journal of medicinal chemistry, Dec-10, Volume: 58, Issue:23 ISSN: 1520-4804 | Discovery of Inhibitors That Overcome the G1202R Anaplastic Lymphoma Kinase Resistance Mutation. |
AID1915687 | Cytotoxicity against mouse BaF3 cells expressing human EGFR C797S/T790M/del19 mutant assessed as inhibition of in cell viability measured after 72 hrs by CellTiter-Glo assay | 2021 | European journal of medicinal chemistry, Jan-15, Volume: 210ISSN: 1768-3254 | The new opportunities in medicinal chemistry of fourth-generation EGFR inhibitors to overcome C797S mutation. |
AID1310801 | Inhibition of human ALK using poly[Glu:Tyr] (4:1) as substrate and [gamma-33P]ATP measured after 1 hr | 2016 | Journal of medicinal chemistry, 05-26, Volume: 59, Issue:10 ISSN: 1520-4804 | Discovery of Brigatinib (AP26113), a Phosphine Oxide-Containing, Potent, Orally Active Inhibitor of Anaplastic Lymphoma Kinase. |
AID1267046 | Antiproliferative activity against human LAN1 cells expressing EML4-ALK F1174L mutant after 72 hrs by CellTiter-Glo Luminescent Cell Viability Assay | 2015 | Journal of medicinal chemistry, Dec-10, Volume: 58, Issue:23 ISSN: 1520-4804 | Discovery of Inhibitors That Overcome the G1202R Anaplastic Lymphoma Kinase Resistance Mutation. |
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. |
AID1347412 | qHTS assay to identify inhibitors of the type 1 interferon - major histocompatibility complex class I in skeletal muscle: Counter screen cell viability and HiBit confirmation | 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. |
AID1801919 | Kinase Assay from Article 10.1021/acschembio.5b00940: \\Structural and Functional Analysis of the Allosteric Inhibition of IRE1a with ATP-Competitive Ligands.\\ | 2016 | ACS chemical biology, 08-19, Volume: 11, Issue:8 ISSN: 1554-8937 | Structural and Functional Analysis of the Allosteric Inhibition of IRE1α with ATP-Competitive Ligands. |
Timeframe | Studies, This Drug (%) | All Drugs % |
---|---|---|
pre-1990 | 0 (0.00) | 18.7374 |
1990's | 0 (0.00) | 18.2507 |
2000's | 0 (0.00) | 29.6817 |
2010's | 6 (60.00) | 24.3611 |
2020's | 4 (40.00) | 2.80 |
Publication Type | This drug (%) | All Drugs (%) |
---|---|---|
Trials | 0 (0.00%) | 5.53% |
Reviews | 1 (10.00%) | 6.00% |
Case Studies | 0 (0.00%) | 4.05% |
Observational | 0 (0.00%) | 0.25% |
Other | 9 (90.00%) | 84.16% |
Condition | Indicated | Studies | First Year | Last Year | Average Age | Relationship Strength | Trials | pre-1990 | 1990's | 2000's | 2010's | post-2020 |
---|---|---|---|---|---|---|---|---|---|---|---|---|
Cancer of Lung | 0 | 2015 | 2021 | 6.5 | medium | 0 | 0 | 0 | 0 | 3 | 1 | |
Carcinoma, Non-Small Cell Lung | 0 | 2015 | 2021 | 6.5 | medium | 0 | 0 | 0 | 0 | 3 | 1 | |
Carcinoma, Non-Small-Cell Lung | 0 | 2015 | 2021 | 6.5 | medium | 0 | 0 | 0 | 0 | 3 | 1 | |
Congenital Zika Syndrome | 0 | 2020 | 2020 | 4.0 | low | 0 | 0 | 0 | 0 | 1 | 0 | |
Disease Models, Animal | 0 | 2020 | 2020 | 4.0 | low | 0 | 0 | 0 | 0 | 1 | 0 | |
Experimental Neoplasms | 0 | 2016 | 2016 | 8.0 | low | 0 | 0 | 0 | 0 | 1 | 0 | |
Lung Neoplasms | 0 | 2015 | 2021 | 6.5 | medium | 0 | 0 | 0 | 0 | 3 | 1 | |
Neuroblastoma | 0 | 2015 | 2015 | 9.0 | low | 0 | 0 | 0 | 0 | 1 | 0 | |
Zika Virus Infection | 0 | 2020 | 2020 | 4.0 | low | 0 | 0 | 0 | 0 | 1 | 0 |
Article | Year |
---|---|
A High-Throughput Screen of a Library of Therapeutics Identifies Cytotoxic Substrates of P-glycoprotein. Molecular pharmacology, , Volume: 96, Issue:5 | 2019 |
Article | Year |
---|---|
Discovery of Inhibitors That Overcome the G1202R Anaplastic Lymphoma Kinase Resistance Mutation. Journal of medicinal chemistry, , Dec-10, Volume: 58, Issue:23 | 2015 |