Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '72 kDa type IV collagenase' and Ligand = 'BDBM50371337'   

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
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50371337 (CHEMBL439066) Show SMILES Cc1cc(COc2ccc(cc2)C(=O)N[C@@H]2CN(Cc3ccco3)C[C@@H]2C(=O)NO)c2ccccc2n1 Show InChI InChI=1S/C28H28N4O5/c1-18-13-20(23-6-2-3-7-25(23)29-18)17-37-21-10-8-19(9-11-21)27(33)30-26-16-32(14-22-5-4-12-36-22)15-24(26)28(34)31-35/h2-13,24,26,35H,14-17H2,1H3,(H,30,33)(H,31,34)/t24-,26+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>3.33E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Research and Development Curated by ChEMBL					Assay Description Binding affinity to MMP2				Bioorg Med Chem Lett 18: 694-9 (2008) Article DOI: 10.1016/j.bmcl.2007.11.059 BindingDB Entry DOI: 10.7270/Q2BV7HGG
					More data for this Ligand-Target Pair