Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '72 kDa type IV collagenase' and Ligand = 'BDBM50297246'   

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))	BDBM50297246 ((2S,3R)-3-hydroxy-2-(4'-(4-(methylsulfonamido)benz...) Show SMILES CC(O)[C@H](NS(=O)(=O)c1ccc(cc1)-c1ccc(NC(=O)c2cc3c(NS(C)(=O)=O)cccc3o2)cc1)C(O)=O |r| Show InChI InChI=1S/C26H25N3O9S2/c1-15(30)24(26(32)33)29-40(36,37)19-12-8-17(9-13-19)16-6-10-18(11-7-16)27-25(31)23-14-20-21(28-39(2,34)35)4-3-5-22(20)38-23/h3-15,24,28-30H,1-2H3,(H,27,31)(H,32,33)/t15?,24-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.47E+3	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of MMP2				Bioorg Med Chem Lett 19: 4546-50 (2009) Article DOI: 10.1016/j.bmcl.2009.07.008 BindingDB Entry DOI: 10.7270/Q2MW2H6T
					More data for this Ligand-Target Pair