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BDBM50108471 3-[3'-(1H-Benzoimidazol-2-ylamino)-biphenyl-3-sulfonylamino]-3-phenyl-propionic acid::CHEMBL292343

SMILES: OC(=O)CC(NS(=O)(=O)c1cccc(c1)-c1cccc(Nc2nc3ccccc3[nH]2)c1)c1ccccc1

InChI Key: InChIKey=CNEKZXJTDXCVRA-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50108471   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Integrin alpha-V/beta-3


(Homo sapiens (Human))		BDBM50108471
PNG
(3-[3'-(1H-Benzoimidazol-2-ylamino)-biphenyl-3-sulf...)
Show SMILES OC(=O)CC(NS(=O)(=O)c1cccc(c1)-c1cccc(Nc2nc3ccccc3[nH]2)c1)c1ccccc1
Show InChI InChI=1S/C28H24N4O4S/c33-27(34)18-26(19-8-2-1-3-9-19)32-37(35,36)23-13-7-11-21(17-23)20-10-6-12-22(16-20)29-28-30-24-14-4-5-15-25(24)31-28/h1-17,26,32H,18H2,(H,33,34)(H2,29,30,31)
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PubMed
 4n/an/an/an/an/an/an/an/a



Bayer AG

Curated by ChEMBL


Assay Description
In vitro activity in an vitronectin receptor (alpha v beta3) scintillation bead assay using 125-I labelled echistatin as a radioligand

Bioorg Med Chem Lett 12: 205-8 (2001)


BindingDB Entry DOI: 10.7270/Q27945T7
More data for this
Ligand-Target Pair