Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '72 kDa type IV collagenase' and Ligand = 'BDBM191769'   

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))	BDBM191769 (US11608309, Compound 6 | US9187406, Compound 6) Show SMILES COc1cc(\C=C\C(=O)C(C(=O)Nc2ccccc2)C(=O)\C=C\c2ccc(O)c(OC)c2)ccc1O Show InChI InChI=1S/C28H25NO7/c1-35-25-16-18(8-12-21(25)30)10-14-23(32)27(28(34)29-20-6-4-3-5-7-20)24(33)15-11-19-9-13-22(31)26(17-19)36-2/h3-17,27,30-31H,1-2H3,(H,29,34)/b14-10+,15-11+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	8.50E+4	n/a	n/a	n/a	n/a	n/a	37
The Research Foundation of State University of New York; Chem-Master International, Inc. US Patent					Assay Description It has been observed that 50 and 100 μM concentrations of curcumin decreased TNFα production by endotoxin-stimulated human monocytes (HMs) ...				US Patent US9187406 (2015) BindingDB Entry DOI: 10.7270/Q2KH0M3V
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