BDBM50125316 (S)-2-(2-Methanesulfonyl-benzenesulfonylamino)-3-[3'-(3-propyl-ureido)-biphenyl-4-yl]-propionic acid::CHEMBL11447

SMILES: CCCNC(=O)Nc1cccc(c1)-c1ccc(C[C@H](NS(=O)(=O)c2ccccc2S(C)(=O)=O)C(O)=O)cc1

InChI Key: InChIKey=OAIGFBSQRZQQSH-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 = 50125316   

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))	BDBM50125316 ((S)-2-(2-Methanesulfonyl-benzenesulfonylamino)-3-[...) Show SMILES CCCNC(=O)Nc1cccc(c1)-c1ccc(C[C@H](NS(=O)(=O)c2ccccc2S(C)(=O)=O)C(O)=O)cc1 Show InChI InChI=1S/C26H29N3O7S2/c1-3-15-27-26(32)28-21-8-6-7-20(17-21)19-13-11-18(12-14-19)16-22(25(30)31)29-38(35,36)24-10-5-4-9-23(24)37(2,33)34/h4-14,17,22,29H,3,15-16H2,1-2H3,(H,30,31)(H2,27,28,32)/t22-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	>1.00E+4	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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