Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Integrin alpha-V' and Ligand = 'BDBM50277098'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Integrin alpha-V (Homo sapiens (Human))	BDBM50277098 (3-[1-Oxo-6-(1,2,3,4-tetrahydro-benzo[4,5]imidazo[1...) Show SMILES OC(=O)CCN1CCc2cc(Oc3cccc4n5CCCNc5nc34)ccc2C1=O Show InChI InChI=1S/C22H22N4O4/c27-19(28)8-12-25-11-7-14-13-15(5-6-16(14)21(25)29)30-18-4-1-3-17-20(18)24-22-23-9-2-10-26(17)22/h1,3-6,13H,2,7-12H2,(H,23,24)(H,27,28)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
Pharmacopeia, Inc. Curated by ChEMBL					Assay Description Binding affinity to human integrin alphavbeta3 receptor by TRF assay				Bioorg Med Chem Lett 19: 352-5 (2008) Article DOI: 10.1016/j.bmcl.2008.11.074 BindingDB Entry DOI: 10.7270/Q2N016C9
					More data for this Ligand-Target Pair
Integrin alpha-V (Homo sapiens (Human))	BDBM50277098 (3-[1-Oxo-6-(1,2,3,4-tetrahydro-benzo[4,5]imidazo[1...) Show SMILES OC(=O)CCN1CCc2cc(Oc3cccc4n5CCCNc5nc34)ccc2C1=O Show InChI InChI=1S/C22H22N4O4/c27-19(28)8-12-25-11-7-14-13-15(5-6-16(14)21(25)29)30-18-4-1-3-17-20(18)24-22-23-9-2-10-26(17)22/h1,3-6,13H,2,7-12H2,(H,23,24)(H,27,28)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	310	n/a	n/a	n/a	n/a	n/a	n/a
Pharmacopeia, Inc. Curated by ChEMBL					Assay Description Binding affinity to human integrin alphavbeta5 receptor by TRF assay				Bioorg Med Chem Lett 19: 352-5 (2008) Article DOI: 10.1016/j.bmcl.2008.11.074 BindingDB Entry DOI: 10.7270/Q2N016C9
					More data for this Ligand-Target Pair