BDBM50125293 (S)-2-(5-Chloro-2-methoxy-benzenesulfonylamino)-3-[3'-(3-propyl-ureido)-biphenyl-4-yl]-propionic acid::CHEMBL417792

SMILES: CCCNC(=O)Nc1cccc(c1)-c1ccc(C[C@H](NS(=O)(=O)c2cc(Cl)ccc2OC)C(O)=O)cc1

InChI Key: InChIKey=IVKRXCQCXTVMDX-QFIPXVFZSA-N

Data: 1 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 1 hit for monomerid = 50125293   

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))	BDBM50125293 ((S)-2-(5-Chloro-2-methoxy-benzenesulfonylamino)-3-...) Show SMILES CCCNC(=O)Nc1cccc(c1)-c1ccc(C[C@H](NS(=O)(=O)c2cc(Cl)ccc2OC)C(O)=O)cc1 Show InChI InChI=1S/C26H28ClN3O6S/c1-3-13-28-26(33)29-21-6-4-5-19(15-21)18-9-7-17(8-10-18)14-22(25(31)32)30-37(34,35)24-16-20(27)11-12-23(24)36-2/h4-12,15-16,22,30H,3,13-14H2,1-2H3,(H,31,32)(H2,28,29,33)/t22-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.70E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bayer AG Curated by ChEMBL					Assay Description Binding affinity towards vitronectin receptor (alpha V-beta3) was determined				Bioorg Med Chem Lett 13: 1071-4 (2003) BindingDB Entry DOI: 10.7270/Q2S46T44
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