BDBM50231145 CHEMBL76785

SMILES: CCCCc1nc2cccc(C(O)=O)c2nc1Oc1ccc(cc1)-c1ccccc1-c1nn[nH]n1

InChI Key: InChIKey=MVEVPCZFYOMXJQ-UHFFFAOYSA-N

Data: 3 KI

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 = 50231145   

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 receptor (AT-1) type-1 (RAT)	BDBM50231145 (CHEMBL76785) Show SMILES CCCCc1nc2cccc(C(O)=O)c2nc1Oc1ccc(cc1)-c1ccccc1-c1nn[nH]n1 Show InChI InChI=1S/C26H22N6O3/c1-2-3-10-22-25(28-23-20(26(33)34)9-6-11-21(23)27-22)35-17-14-12-16(13-15-17)18-7-4-5-8-19(18)24-29-31-32-30-24/h4-9,11-15H,2-3,10H2,1H3,(H,33,34)(H,29,30,31,32)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Binding affinity of compound in presence of bovine serum albumin (BSA) at 0% against rat Angiotensin II receptor, type 1				J Med Chem 36: 2335-42 (1993) Article DOI: 10.1021/jm00068a010 BindingDB Entry DOI: 10.7270/Q21V5H6B
					More data for this Ligand-Target Pair
Angiotensin II receptor (AT-1) type-1 (RAT)	BDBM50231145 (CHEMBL76785) Show SMILES CCCCc1nc2cccc(C(O)=O)c2nc1Oc1ccc(cc1)-c1ccccc1-c1nn[nH]n1 Show InChI InChI=1S/C26H22N6O3/c1-2-3-10-22-25(28-23-20(26(33)34)9-6-11-21(23)27-22)35-17-14-12-16(13-15-17)18-7-4-5-8-19(18)24-29-31-32-30-24/h4-9,11-15H,2-3,10H2,1H3,(H,33,34)(H,29,30,31,32)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	46	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Binding affinity of compound in presence of bovine serum albumin (BSA) at 0.01% against rat Angiotensin II receptor, type 1				J Med Chem 36: 2335-42 (1993) Article DOI: 10.1021/jm00068a010 BindingDB Entry DOI: 10.7270/Q21V5H6B
					More data for this Ligand-Target Pair
Angiotensin II receptor (AT-1) type-1 (RAT)	BDBM50231145 (CHEMBL76785) Show SMILES CCCCc1nc2cccc(C(O)=O)c2nc1Oc1ccc(cc1)-c1ccccc1-c1nn[nH]n1 Show InChI InChI=1S/C26H22N6O3/c1-2-3-10-22-25(28-23-20(26(33)34)9-6-11-21(23)27-22)35-17-14-12-16(13-15-17)18-7-4-5-8-19(18)24-29-31-32-30-24/h4-9,11-15H,2-3,10H2,1H3,(H,33,34)(H,29,30,31,32)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	46	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Binding affinity for Angiotensin II receptor, type 1 in rat adrenal cortical membranes using [125I]Sar1, Ile8-angiotensin II				J Med Chem 36: 2335-42 (1993) Article DOI: 10.1021/jm00068a010 BindingDB Entry DOI: 10.7270/Q21V5H6B
					More data for this Ligand-Target Pair