BDBM50072479 CHEMBL327089::[(S)-7-[(1H-Benzoimidazol-2-ylmethyl)-carbamoyl]-3-oxo-4-(2-pyridin-3-yl-ethyl)-2,3,4,5-tetrahydro-1H-benzo[e][1,4]diazepin-2-yl]-acetic acid

SMILES: OC(=O)C[C@@H]1Nc2ccc(cc2CN(CCc2cccnc2)C1=O)C(=O)NCc1nc2ccccc2[nH]1

InChI Key: InChIKey=WWUFFAAECGTHCS-QHCPKHFHSA-N

Data: 1 KI  1 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 2 hits for monomerid = 50072479   

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
ITGAV/ITGB3 (Homo sapiens (Human))	BDBM50072479 (CHEMBL327089 | [(S)-7-[(1H-Benzoimidazol-2-ylmethy...) Show SMILES OC(=O)C[C@@H]1Nc2ccc(cc2CN(CCc2cccnc2)C1=O)C(=O)NCc1nc2ccccc2[nH]1 Show InChI InChI=1S/C27H26N6O4/c34-25(35)13-23-27(37)33(11-9-17-4-3-10-28-14-17)16-19-12-18(7-8-20(19)30-23)26(36)29-15-24-31-21-5-1-2-6-22(21)32-24/h1-8,10,12,14,23,30H,9,11,13,15-16H2,(H,29,36)(H,31,32)(H,34,35)/t23-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Effect against adhesion of HEK 293 cells transfected with human alpha-v beta-3 to vitronectin coated plates				Bioorg Med Chem Lett 8: 3165-70 (1999) BindingDB Entry DOI: 10.7270/Q2NG4PSF
					More data for this Ligand-Target Pair
ITGAV/ITGB3 (Homo sapiens (Human))	BDBM50072479 (CHEMBL327089 | [(S)-7-[(1H-Benzoimidazol-2-ylmethy...) Show SMILES OC(=O)C[C@@H]1Nc2ccc(cc2CN(CCc2cccnc2)C1=O)C(=O)NCc1nc2ccccc2[nH]1 Show InChI InChI=1S/C27H26N6O4/c34-25(35)13-23-27(37)33(11-9-17-4-3-10-28-14-17)16-19-12-18(7-8-20(19)30-23)26(36)29-15-24-31-21-5-1-2-6-22(21)32-24/h1-8,10,12,14,23,30H,9,11,13,15-16H2,(H,29,36)(H,31,32)(H,34,35)/t23-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	350	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Binding affinity evaluated against vitronectin receptor (alphaV-beta3) receptor				Bioorg Med Chem Lett 8: 3165-70 (1999) BindingDB Entry DOI: 10.7270/Q2NG4PSF
					More data for this Ligand-Target Pair