Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Collagenase 3' and Ligand = 'BDBM50105433'   

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
Collagenase 3 (Homo sapiens (Human))	BDBM50105433 (CHEMBL329104 | [(S)-1-Hydroxycarbamoyl-2-(4-phenox...) Show SMILES CC(C)(C)OC(=O)N[C@H](CS(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(=O)NO Show InChI InChI=1S/C20H24N2O7S/c1-20(2,3)29-19(24)21-17(18(23)22-25)13-30(26,27)16-11-9-15(10-12-16)28-14-7-5-4-6-8-14/h4-12,17,25H,13H2,1-3H3,(H,21,24)(H,22,23)/t17-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of Matrix metalloproteinase-13				Bioorg Med Chem Lett 11: 2719-22 (2001) BindingDB Entry DOI: 10.7270/Q2TD9WNW
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