BDBM50125285 (S)-2-(3-Benzyl-ureido)-3-[3'-(3-propyl-ureido)-biphenyl-4-yl]-propionic acid::CHEMBL10871

SMILES: CCCNC(=O)Nc1cccc(c1)-c1ccc(C[C@H](NC(=O)NCc2ccccc2)C(O)=O)cc1

InChI Key: InChIKey=UQBMIQDDAZKSBW-DEOSSOPVSA-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 = 50125285   

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))	BDBM50125285 ((S)-2-(3-Benzyl-ureido)-3-[3'-(3-propyl-ureido)-bi...) Show SMILES CCCNC(=O)Nc1cccc(c1)-c1ccc(C[C@H](NC(=O)NCc2ccccc2)C(O)=O)cc1 Show InChI InChI=1S/C27H30N4O4/c1-2-15-28-26(34)30-23-10-6-9-22(17-23)21-13-11-19(12-14-21)16-24(25(32)33)31-27(35)29-18-20-7-4-3-5-8-20/h3-14,17,24H,2,15-16,18H2,1H3,(H,32,33)(H2,28,30,34)(H2,29,31,35)/t24-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	850	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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