bromebric acid

Description

bromebric acid: major descriptor (74-86); on line search ACRYLATES (74-86); INDEX MEDICUS search BROMEBRIC ACID (74-86); RN given refers to parent cpd [MeSH]

bromebric acid : no description available [CHeBI]

Cross-References

ID Source	ID
PubMed CID	5358572
CHEMBL ID	2106594
SCHEMBL ID	2110065
CHEBI ID	135179
MeSH ID	M0263162

Synonyms (35)

Synonym
mbba (free acid)
nsc-265480
5711-40-0
nsc265480
(e)-3-p-anisoyl-3-bromoacrylic acid
bromebric acid
2-butenoic acid, 3-bromo-4-(4-methoxyphenyl)-4-oxo-, sodium salt, (e)-
(e)-3-bromo-4-(4-methoxyphenyl)-4-oxo-but-2-enoic acid
cytembena
bromebric acid [inn:ban]
acidum bromebricum
acide bromebrique
nsc 104801
(e)-3-p-anisoyl-3-bromacrylsaeure
bromebrinsaeure
acido bromebrico
CHEBI:135179
HMS2089L16
cas-5711-40-0
dtxsid9046231 ,
dtxcid7026231
tox21_111900
fge8818gwa ,
unii-fge8818gwa
bromebric acid [inn]
(e)-3-(p-anisoyl)-3-bromoacrylic acid
2-butenoic acid, 3-bromo-4-(4-methoxyphenyl)-4-oxo-, (2e)-
CHEMBL2106594
DL-221
SCHEMBL2110065
sr-05000001481
SR-05000001481-1
bromebric
bromebricacid
Q27277977

Drug Classes (1)

Class	Description
carbonyl compound	Any compound containing the carbonyl group, C=O. The term is commonly used in the restricted sense of aldehydes and ketones, although it actually includes carboxylic acids and derivatives.

Protein Targets (8)

Potency Measurements

Protein	Taxonomy	Measurement	Average (mM)	Bioassay(s)
TDP1 protein	Homo sapiens (human)	Potency	16.2582	AID686978; AID686979
AR protein	Homo sapiens (human)	Potency	26.0622	AID743042; AID743054; AID743063
estrogen nuclear receptor alpha	Homo sapiens (human)	Potency	11.0581	AID743069; AID743075; AID743077; AID743078; AID743080; AID743091
peroxisome proliferator activated receptor gamma	Homo sapiens (human)	Potency	8.4852	AID743094; AID743140
cytochrome P450, family 19, subfamily A, polypeptide 1, isoform CRA_a	Homo sapiens (human)	Potency	29.8493	AID743083
Cellular tumor antigen p53	Homo sapiens (human)	Potency	12.7755	AID651631; AID720552
ATPase family AAA domain-containing protein 5	Homo sapiens (human)	Potency	10.7981	AID651632; AID720516
Ataxin-2	Homo sapiens (human)	Potency	10.5909	AID651632

Bioassays (3)

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.

Research

Studies (13)

Timeframe	Studies, This Drug (%)	All Drugs %
pre-1990	10 (76.92)	18.7374
1990's	1 (7.69)	18.2507
2000's	0 (0.00)	29.6817
2010's	1 (7.69)	24.3611
2020's	1 (7.69)	2.80

Study Types

Publication Type	This drug (%)	All Drugs (%)
Trials	1 (7.14%)	5.53%
Reviews	0 (0.00%)	6.00%
Case Studies	0 (0.00%)	4.05%
Observational	0 (0.00%)	0.25%
Other	13 (92.86%)	84.16%

Substance	Classes	Roles	Relationship Strength
salophen	carbonyl compound		low
aklomide	carbonyl compound; organohalogen compound		low
ethyl citrate	carbonyl compound		low
tributyl citrate	carbonyl compound		low
benzoyl peroxide	carbonyl compound		low
chelidonic acid	carbonyl compound; pyrans		low
toness	carbonyl compound		low
phenyl 4-aminosalicylate	carbonyl compound		low
2-Methoxybenzaldehyde	carbonyl compound		low
acetylsalicylsalicylic acid	carbonyl compound		low
evernic acid	carbonyl compound		low
2,6-dimethoxybenzoic acid	benzenes; carbonyl compound		low
trimethylolpropane trimethacrylate	carbonyl compound		low
2,4,5-trimethoxybenzaldehyde	carbonyl compound		low
benorilate	carbonyl compound		low
3,4-dimethylbenzaldehyde	carbonyl compound		low
psoromic acid	carbonyl compound		low
trimethylolpropane triacrylate	carbonyl compound		low
flurofamide	carbonyl compound; organohalogen compound		low
Eugenyl benzoate	carbonyl compound		low
simvastatin acid	carbonyl compound		low
magnesium salicylate	benzenes; carbonyl compound		low
physodic acid	carbonyl compound		low
toxoflavin	carbonyl compound; pyrimidotriazine	antibacterial agent; antineoplastic agent; apoptosis inducer; bacterial metabolite; toxin; virulence factor; Wnt signalling inhibitor	low
atranorin	carbonyl compound		low
guacetisal	carbonyl compound		low
alloclamide	carbonyl compound; organohalogen compound		low
lobaric acid	carbonyl compound		low
carbetapentane citrate	carbonyl compound		low
diffractaic acid	carbonyl compound		low
fluorocitrate	carbonyl compound		low
nitroaspirin	carbonyl compound		low
hydroxycitric acid	carbonyl compound		low
4-iodo-n-piperidinoethylbenzamide	carbonyl compound; organohalogen compound		low
gyrophoric acid	carbonyl compound		low
barbatic acid	carbonyl compound		low
perlatolinic acid	carbonyl compound		low
vernodalin	carbonyl compound		low
hydroxycitric acid	carbonyl compound		low
2-[(2-methoxy-2-oxoethyl)thio]benzoic acid methyl ester	carbonyl compound		low
olivetoric acid	carbonyl compound		low
3-butene-1,2,3-tricarboxylic acid	carbonyl compound		low
3-bromo-N-[2-(4-nitroanilino)ethyl]benzamide	carbonyl compound; organohalogen compound		low
4-chloro-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)benzamide	carbonyl compound; organohalogen compound		low
2-(2-methoxyethylthio)-N-(1,3,4-thiadiazol-2-yl)benzamide	carbonyl compound		low
2,4-difluoro-N-[[(5-methyl-1H-pyrazol-3-yl)amino]-oxomethyl]benzamide	carbonyl compound; organohalogen compound		low
3-(4-methylbenzoyl)acrylic acid	carbonyl compound		low
2-chloro-N-(2-phenylethyl)benzamide	carbonyl compound; organohalogen compound		low
N-[2-(1-cyclohexenyl)ethyl]-4-fluorobenzamide	carbonyl compound; organohalogen compound		low
N-[2-(1H-benzimidazol-2-yl)ethyl]-4-chloro-3-nitrobenzamide	carbonyl compound; organohalogen compound		low
N'-[(4-chlorophenyl)-oxomethyl]-2-pyrazinecarbohydrazide	carbonyl compound; organohalogen compound		low
1-azepanyl-[2-methoxy-4-(methylthio)phenyl]methanone	carbonyl compound; thiol		low
4-chloro-N-(4-methyl-2-thiazolyl)-2-nitrobenzamide	carbonyl compound; organohalogen compound		low
3-fluoro-N-(1H-1,2,4-triazol-5-yl)benzamide	carbonyl compound; organohalogen compound		low
3-bromo-N-(2-furanylmethyl)benzamide	carbonyl compound; organohalogen compound		low
N'-[(2-chlorophenyl)-oxomethyl]-2-thiophenecarbohydrazide	carbonyl compound; organohalogen compound		low
n-(1,3-benzodioxol-5-ylmethyl)-2,6-dichlorobenzamide	carbonyl compound; organohalogen compound		low
4-fluoro-N-(5-methyl-2-pyridinyl)benzamide	carbonyl compound; organohalogen compound		low
2-methoxy-4-(methylthio)-N-pyridin-4-ylbenzamide	carbonyl compound; thiol		low
2-chloro-4,5-difluoro-N-(5-methyl-2-pyridinyl)benzamide	carbonyl compound; organohalogen compound		low
3-bromo-N-[(tert-butylamino)-sulfanylidenemethyl]-4-methoxybenzamide	carbonyl compound; organohalogen compound		low
4-chloro-N-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]benzamide	carbonyl compound; organohalogen compound		low
N'-(1,3-benzothiazol-2-yl)-4-fluorobenzohydrazide	carbonyl compound; organohalogen compound		low
4-chloro-N-(1,2-dimethyl-5-benzimidazolyl)benzamide	carbonyl compound; organohalogen compound		low
1-[[(2-chlorophenyl)-oxomethyl]amino]-3-(2-methoxy-5-methylphenyl)thiourea	carbonyl compound; organohalogen compound		low
2-bromo-N-[2,3-dihydroindol-1-yl(sulfanylidene)methyl]benzamide	carbonyl compound; organohalogen compound		low
4-bromo-N'-[(4-bromophenyl)-oxomethyl]-1-methyl-3-pyrazolecarbohydrazide	carbonyl compound; organohalogen compound		low
2-fluoro-N-[2-(3-pyridinyl)-3H-benzimidazol-5-yl]benzamide	carbonyl compound; organohalogen compound		low
[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-[2-(ethylthio)phenyl]methanone	carbonyl compound		low
N'-[2,6-bis(4-morpholinyl)-4-pyrimidinyl]-2,4-dichlorobenzohydrazide	carbonyl compound; organohalogen compound		low
N'-[2,6-bis(4-morpholinyl)-4-pyrimidinyl]-3,4-dichlorobenzohydrazide	carbonyl compound; organohalogen compound		low
4-fluoro-N-(3-pyridinyl)benzamide	carbonyl compound; organohalogen compound		low
4-bromo-N'-(3,4-dihydro-2H-pyrrol-5-yl)benzohydrazide	carbonyl compound; organohalogen compound		low
1-(4-bromophenyl)-4-[1-naphthalenyl(oxo)methyl]-3-pyrazolecarboxylic acid ethyl ester	carbonyl compound; naphthalenes		low
4-methyl-3-(4-morpholinylsulfonyl)benzoic acid [3-[[oxo(thiophen-2-yl)methyl]amino]phenyl] ester	carbonyl compound		low
3-[(2,4-difluorophenoxy)methyl]-4-methoxybenzaldehyde	carbonyl compound		low
4-bromo-3-nitrobenzoic acid [2-[anilino(oxo)methyl]phenyl] ester	carbonyl compound		low
2-bromo-N'-[(3-chlorophenyl)-oxomethyl]benzohydrazide	carbonyl compound; organohalogen compound		low
3-chloro-N-(2-methyl-3-oxo-1,2,4-thiadiazol-5-yl)benzamide	carbonyl compound; organohalogen compound		low
3,4-dichloro-N-(4-chloro-3-methyl-5-isoxazolyl)benzamide	carbonyl compound; organohalogen compound		low
3,4-dichloro-N-(2-thiophen-2-ylethyl)benzamide	carbonyl compound; organohalogen compound		low
3-chloro-N-[3-[[(3-chloro-4-nitrophenyl)-oxomethyl]amino]-2,2-dimethylpropyl]-4-nitrobenzamide	carbonyl compound; organohalogen compound		low
4-chloro-N-[[[oxo-(3,4,5-trimethoxyphenyl)methyl]hydrazo]-sulfanylidenemethyl]benzamide	carbonyl compound; organohalogen compound		low
3-bromo-4-methoxy-N-[(propan-2-ylamino)-sulfanylidenemethyl]benzamide	carbonyl compound; organohalogen compound		low
2-(2-methoxyethylthio)-N-(2-thiazolyl)benzamide	carbonyl compound		low
2-(2-methoxyethylthio)-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide	carbonyl compound		low
3-bromo-N-[(2-hydroxyethylamino)-sulfanylidenemethyl]-4-methoxybenzamide	carbonyl compound; organohalogen compound		low
N-[[[(2,4-dichlorophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2,2-dimethylpropanamide	carbonyl compound; organohalogen compound		low
4-chloro-N-[(2-methylpropylamino)-sulfanylidenemethyl]benzamide	carbonyl compound; organohalogen compound		low
2-chloro-N-[(2-pyrimidinylamino)-sulfanylidenemethyl]benzamide	carbonyl compound; organohalogen compound		low
N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-thiazolyl]-4-chlorobenzamide	carbonyl compound; organohalogen compound		low
N-(3,5-dichloro-2-pyridinyl)-2-methoxy-4-(methylthio)benzamide	carbonyl compound; thiol		low
2-[[[[(4-fluorophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-4-(5-methyl-2-furanyl)-3-thiophenecarboxylic acid ethyl ester	carbonyl compound; organohalogen compound		low
N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-fluorobenzamide	carbonyl compound; organohalogen compound		low
2-(1,3,4-oxadiazol-2-yl)phenyl 4-chlorobenzoate	carbonyl compound		low
N'-[(4-chlorophenyl)-oxomethyl]-2-thiophen-2-yl-4-thiazolecarbohydrazide	carbonyl compound; organohalogen compound		low
N'-[(4-chlorophenyl)-oxomethyl]-2-methyl-4-thiazolecarbohydrazide	carbonyl compound; organohalogen compound		low
N-[2-cyano-5-(cyanomethylthio)-4-phenyl-3-thiophenyl]-4-fluorobenzamide	carbonyl compound; organohalogen compound		low
2-chloro-N-[(methylcarbamoylamino)-sulfanylidenemethyl]benzamide	carbonyl compound; organohalogen compound		low
t 0070907	carbonyl compound; organohalogen compound		low
4-fluoro-N-(7-methyl-4-oxo-2-thieno[3,2-d][1,3]thiazinyl)benzamide	carbonyl compound; organohalogen compound		low
N'-(4-tert-butyl-2-thiazolyl)-4-chlorobenzohydrazide	carbonyl compound; organohalogen compound		low
N-(4-bromo-2-tert-butyl-5-methyl-3-pyrazolyl)-2,4-dichlorobenzamide	carbonyl compound; organohalogen compound		low
2-[(3-methoxyphenyl)-oxomethyl]-3,3-bis(methylthio)-2-propenenitrile	carbonyl compound		low
4-chloro-N-[2-(4-nitroanilino)ethyl]benzamide	carbonyl compound; organohalogen compound		low
(2-chlorophenyl)-(5-hydroxy-3-methyl-5-phenyl-4H-pyrazol-1-yl)methanone	carbonyl compound; organohalogen compound		low
5-chloro-N-[2-(2-furanyl)-2-(1-pyrrolidinyl)ethyl]-2-methoxybenzamide	carbonyl compound; organohalogen compound		low
(3-bromophenyl)-[5-(4-bromophenyl)-3-ethyl-5-hydroxy-4H-pyrazol-1-yl]methanone	carbonyl compound; organohalogen compound		low
3-chloro-N-(5-chloro-2-pyridinyl)-4-ethoxybenzamide	carbonyl compound; organohalogen compound		low
2-fluoro-N-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)benzamide	carbonyl compound; organohalogen compound		low
N-[[[(2-chlorophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-nitrobenzamide	carbonyl compound; organohalogen compound		low
4-chloro-N-[5-(2,3-dihydro-1,4-dioxin-5-yl)-1,3,4-oxadiazol-2-yl]benzamide	carbonyl compound; organohalogen compound		low
2-(2-cyanophenyl)sulfinyl-N-methylbenzamide	carbonyl compound		low
4-fluoro-N-[[2-(3-pyridinyl)-1-piperidinyl]-sulfanylidenemethyl]benzamide	carbonyl compound; organohalogen compound		low
N-[[[(4-fluorophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-furancarboxamide	carbonyl compound; organohalogen compound		low
3-bromo-4-methyl-N-[(2-oxolanylmethylamino)-sulfanylidenemethyl]benzamide	carbonyl compound; organohalogen compound		low
2-chloro-N-[3-[4-[3-[[(2-chloro-5-nitrophenyl)-oxomethyl]amino]propyl]-1-piperazinyl]propyl]-5-nitrobenzamide	carbonyl compound; organohalogen compound		low
2-bromo-N-[[(2-methylcyclohexyl)amino]-sulfanylidenemethyl]benzamide	carbonyl compound; organohalogen compound		low
3-chloro-N-[5-(3-pyridinyl)-1,3,4-oxadiazol-2-yl]benzamide	carbonyl compound; organohalogen compound		low
2-[[2-(cyclohexylamino)-2-oxoethyl]thio]benzoic acid [2-(cyclohexylamino)-2-oxoethyl] ester	carbonyl compound		low
2,4-dichloro-N-[(2,8-dimethyl-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indol-5-yl)-sulfanylidenemethyl]benzamide	carbonyl compound; organohalogen compound		low
1-tert-butyl-3-[[(2-chlorophenyl)-oxomethyl]amino]thiourea	carbonyl compound; organohalogen compound		low
4-bromo-N-[(2,8-dimethyl-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indol-5-yl)-sulfanylidenemethyl]benzamide	carbonyl compound; organohalogen compound		low
reductone	carbonyl compound		low
2,5-dichloro-N-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]benzamide	carbonyl compound; organohalogen compound		low
fulvoplumierin	carbonyl compound; pyrans		low
fumarprotocetraric acid	carbonyl compound		low
baeomycesic acid	carbonyl compound		low
Squamatic acid	carbonyl compound		low
reumycin	carbonyl compound; pyrimidotriazine	antimicrobial agent; antineoplastic agent; bacterial metabolite	low
3-(dimethylamino)-1-phenylprop-2-en-1-one	carbonyl compound		low
protocetraric acid	carbonyl compound		low
N'1-(6-methylpyridazin-3-yl)-4-chlorobenzene-1-carbohydrazide	carbonyl compound; organohalogen compound		low
pnu-282987	carbonyl compound; organohalogen compound		low
iniparib	carbonyl compound; organohalogen compound		low
mumefural	carbonyl compound		low
3-bromo-N-[5-(4-morpholinylsulfonyl)-1,3,4-thiadiazol-2-yl]benzamide	carbonyl compound; organohalogen compound		low
3-bromo-N-[2-[(3R,6S)-6-[(4-methoxyphenyl)methyl]-3-(phenylmethyl)-2,3,5,6-tetrahydroimidazo[1,2-a]imidazol-7-yl]ethyl]-4-methylbenzamide	carbonyl compound; organohalogen compound		low
(2,6-difluorophenyl)-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-1-piperazinyl]methanone	carbonyl compound; organohalogen compound		low
3-[4-[3-(3-fluorophenyl)-3-oxoprop-1-enyl]-1-methyl-2-pyrrolyl]-N-hydroxy-2-propenamide	carbonyl compound		low
N-(1-azabicyclo[2.2.2]octan-3-yl)-6-chloro-7-nitro-1H-benzimidazole-4-carboxamide	carbonyl compound; organohalogen compound		low

Substance	Studies	Classes	Roles	First Year	Last Year	Average Age	Relationship Strength	pre-1990	1990's
3-methylcholanthrene	1	ortho- and peri-fused polycyclic arene	aryl hydrocarbon receptor agonist; carcinogenic agent	1990	1990	34.0	low	0	1
diphenhydramine	2	ether; tertiary amino compound	anti-allergic agent; antidyskinesia agent; antiemetic; antiparkinson drug; antipruritic drug; antitussive; H1-receptor antagonist; local anaesthetic; muscarinic antagonist; oneirogen; sedative	1963	1963	61.0	medium	2	0
2,6-diisocyanatotoluene	1	toluene meta-diisocyanate	allergen; hapten	1990	1990	34.0	medium	0	1
caprolactam	1	caprolactams	human blood serum metabolite	1982	1982	42.0	low	1	0
ziram	1	dithiocarbamate salt; zinc molecular entity	antifungal agrochemical; apoptosis inducer	1990	1990	34.0	low	0	1
toluene 2,4-diisocyanate	1	toluene meta-diisocyanate	allergen; hapten	1990	1990	34.0	low	0	1
embramine	2	diarylmethane		1963	1963	61.0	high	2	0
dioctyl adipate	1	carboxylic ester		1982	1982	42.0	low	1	0
phosphites	1	phosphite ion; trivalent inorganic anion		1990	1990	34.0	low	0	1
organophosphonates	1	divalent inorganic anion; phosphite ion		1990	1990	34.0	low	0	1
dimethyl hydrogen phosphite	1			1990	1990	34.0	medium	0	1

Condition	Studies	First Year	Last Year	Average Age	Relationship Strength	pre-1990
Angioedema	1	1963	1963	61.0	low	1
Angioneurotic Edema	1	1963	1963	61.0	low	1
Ascites	1	1964	1964	60.0	low	1
Asthma	1	1963	1963	61.0	low	1
Asthma, Bronchial	1	1963	1963	61.0	low	1
Benign Neoplasms	1	1964	1964	60.0	low	1
Cancer of Ovary	1	1982	1982	42.0	low	1
Carcinoma	1	1982	1982	42.0	low	1
Carcinoma, Anaplastic	1	1982	1982	42.0	low	1
Cystadenocarcinoma	1	1982	1982	42.0	low	1
Experimental Neoplasms	1	1982	1982	42.0	low	1
Female Genital Neoplasms	1	1964	1964	60.0	low	1
Genital Neoplasms, Female	1	1964	1964	60.0	low	1
Hives	1	1963	1963	61.0	low	1
Neoplasms	1	1964	1964	60.0	low	1
Ovarian Neoplasms	1	1982	1982	42.0	low	1
Pleural Effusion	1	1964	1964	60.0	low	1
Reticulum Cell-Like Sarcoma, Yoshida	1	1980	1980	44.0	low	1
Urticaria	1	1963	1963	61.0	low	1

Bioavailability (1)

Article	Year
A High-Throughput Screen of a Library of Therapeutics Identifies Cytotoxic Substrates of P-glycoprotein. Molecular pharmacology, , Volume: 96, Issue:5	2019