BDBM50059128 CHEMBL74880::[4-Methyl-3-oxo-7-(4-phenyl-piperazine-1-carbonyl)-2,3,4,5-tetrahydro-1H-benzo[e][1,4]diazepin-2-yl]-acetic acid

SMILES: CN1Cc2cc(ccc2NC(CC(O)=O)C1=O)C(=O)N1CCN(CC1)c1ccccc1

InChI Key: InChIKey=DFJRNWLLPOVNCM-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50059128   

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))	BDBM50059128 (CHEMBL74880 | [4-Methyl-3-oxo-7-(4-phenyl-piperazi...) Show SMILES CN1Cc2cc(ccc2NC(CC(O)=O)C1=O)C(=O)N1CCN(CC1)c1ccccc1 Show InChI InChI=1S/C23H26N4O4/c1-25-15-17-13-16(7-8-19(17)24-20(23(25)31)14-21(28)29)22(30)27-11-9-26(10-12-27)18-5-3-2-4-6-18/h2-8,13,20,24H,9-12,14-15H2,1H3,(H,28,29)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Affinity for vitronectin receptor, integrin alphaV-beta3				J Med Chem 40: 2289-92 (1997) Article DOI: 10.1021/jm970205r BindingDB Entry DOI: 10.7270/Q22V2F74
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Homo sapiens (Human))	BDBM50059128 (CHEMBL74880 | [4-Methyl-3-oxo-7-(4-phenyl-piperazi...) Show SMILES CN1Cc2cc(ccc2NC(CC(O)=O)C1=O)C(=O)N1CCN(CC1)c1ccccc1 Show InChI InChI=1S/C23H26N4O4/c1-25-15-17-13-16(7-8-19(17)24-20(23(25)31)14-21(28)29)22(30)27-11-9-26(10-12-27)18-5-3-2-4-6-18/h2-8,13,20,24H,9-12,14-15H2,1H3,(H,28,29)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Affinity for platelet fibrinogen receptor, integrin alpha IIb/beta3				J Med Chem 40: 2289-92 (1997) Article DOI: 10.1021/jm970205r BindingDB Entry DOI: 10.7270/Q22V2F74
					More data for this Ligand-Target Pair