BDBM50072469 CHEMBL105934::{(S)-7-[(1H-Benzoimidazol-2-ylmethyl)-carbamoyl]-3-oxo-2,3,4,5-tetrahydro-1H-benzo[e][1,4]diazepin-2-yl}-acetic acid

SMILES: OC(=O)C[C@@H]1Nc2ccc(cc2CNC1=O)C(=O)NCc1nc2ccccc2[nH]1

InChI Key: InChIKey=OORKISXHRJDTFL-INIZCTEOSA-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 = 50072469   

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))	BDBM50072469 (CHEMBL105934 | {(S)-7-[(1H-Benzoimidazol-2-ylmethy...) Show SMILES OC(=O)C[C@@H]1Nc2ccc(cc2CNC1=O)C(=O)NCc1nc2ccccc2[nH]1 Show InChI InChI=1S/C20H19N5O4/c26-18(27)8-16-20(29)21-9-12-7-11(5-6-13(12)23-16)19(28)22-10-17-24-14-3-1-2-4-15(14)25-17/h1-7,16,23H,8-10H2,(H,21,29)(H,22,28)(H,24,25)(H,26,27)/t16-/m0/s1	PDB GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	30	n/a	n/a	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
ITGAV/ITGB3 (Homo sapiens (Human))	BDBM50072469 (CHEMBL105934 | {(S)-7-[(1H-Benzoimidazol-2-ylmethy...) Show SMILES OC(=O)C[C@@H]1Nc2ccc(cc2CNC1=O)C(=O)NCc1nc2ccccc2[nH]1 Show InChI InChI=1S/C20H19N5O4/c26-18(27)8-16-20(29)21-9-12-7-11(5-6-13(12)23-16)19(28)22-10-17-24-14-3-1-2-4-15(14)25-17/h1-7,16,23H,8-10H2,(H,21,29)(H,22,28)(H,24,25)(H,26,27)/t16-/m0/s1	PDB GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	5.00E+3	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