BDBM50035443 4-[[2'-[N-(tert-Butoxycarbonyl)sulfamoyl]biphenyl-4-yl]methyl]-5-n-butyl-2-[4-carbethoxy-2-(trifluromethyl)phenyl]-2,4-dihydro-3H-1,2,4-trizol-3-one::CHEMBL138654

SMILES: CCCCc1nn(-c2ccc(cc2Cl)C(=O)OCC)c(=O)n1Cc1ccc(cc1)-c1ccccc1S(=O)(=O)NC(=O)OC(C)(C)C

InChI Key: InChIKey=FYOJOPPNONIVSF-UHFFFAOYSA-N

Data: 3 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50035443   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Angiotensin II type 1a (AT-1a) receptor (RABBIT)	BDBM50035443 (4-[[2'-[N-(tert-Butoxycarbonyl)sulfamoyl]biphenyl-...) Show SMILES CCCCc1nn(-c2ccc(cc2Cl)C(=O)OCC)c(=O)n1Cc1ccc(cc1)-c1ccccc1S(=O)(=O)NC(=O)OC(C)(C)C Show InChI InChI=1S/C33H37ClN4O7S/c1-6-8-13-29-35-38(27-19-18-24(20-26(27)34)30(39)44-7-2)32(41)37(29)21-22-14-16-23(17-15-22)25-11-9-10-12-28(25)46(42,43)36-31(40)45-33(3,4)5/h9-12,14-20H,6-8,13,21H2,1-5H3,(H,36,40)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.80	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Tested for in vitro binding affinity against angiotensin I (AT1) receptor to competitively block the specific binding of [125I]- [Sar1,Ile8] AII to a...				J Med Chem 37: 4464-78 (1995) BindingDB Entry DOI: 10.7270/Q2WD3ZK5
					More data for this Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor (RABBIT)	BDBM50035443 (4-[[2'-[N-(tert-Butoxycarbonyl)sulfamoyl]biphenyl-...) Show SMILES CCCCc1nn(-c2ccc(cc2Cl)C(=O)OCC)c(=O)n1Cc1ccc(cc1)-c1ccccc1S(=O)(=O)NC(=O)OC(C)(C)C Show InChI InChI=1S/C33H37ClN4O7S/c1-6-8-13-29-35-38(27-19-18-24(20-26(27)34)30(39)44-7-2)32(41)37(29)21-22-14-16-23(17-15-22)25-11-9-10-12-28(25)46(42,43)36-31(40)45-33(3,4)5/h9-12,14-20H,6-8,13,21H2,1-5H3,(H,36,40)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	1.80	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at AT1 receptor in rabbit aorta membranes				Citation and Details Article DOI: 10.1007/s00044-013-0831-x BindingDB Entry DOI: 10.7270/Q2C82BRJ
					More data for this Ligand-Target Pair
Angiotensin II AT2 (RAT)	BDBM50035443 (4-[[2'-[N-(tert-Butoxycarbonyl)sulfamoyl]biphenyl-...) Show SMILES CCCCc1nn(-c2ccc(cc2Cl)C(=O)OCC)c(=O)n1Cc1ccc(cc1)-c1ccccc1S(=O)(=O)NC(=O)OC(C)(C)C Show InChI InChI=1S/C33H37ClN4O7S/c1-6-8-13-29-35-38(27-19-18-24(20-26(27)34)30(39)44-7-2)32(41)37(29)21-22-14-16-23(17-15-22)25-11-9-10-12-28(25)46(42,43)36-31(40)45-33(3,4)5/h9-12,14-20H,6-8,13,21H2,1-5H3,(H,36,40)	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	306	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description In vitro binding affinity against angiotensin II (AT2) receptor to competitively block the specific binding of [125I]- [Sar1,Ile8] AII to a rat mid b...				J Med Chem 37: 4464-78 (1995) BindingDB Entry DOI: 10.7270/Q2WD3ZK5
					More data for this Ligand-Target Pair