Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 9' and Ligand = 'BDBM50144807'   

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
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50144807 (7-Chloro-3-hydroxy-6-[1,2,4]triazol-4-yl-1H-quinaz...) Show SMILES On1c(=O)[nH]c2cc(Cl)c(cc2c1=O)-n1cnnc1 Show InChI InChI=1S/C10H6ClN5O3/c11-6-2-7-5(9(17)16(19)10(18)14-7)1-8(6)15-3-12-13-4-15/h1-4,19H,(H,14,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	33	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Compound was tested for inhibition of bovine cathepsin D				J Med Chem 60: 6428-6439 (2017) Article DOI: 10.1021/acs.jmedchem.7b00766 BindingDB Entry DOI: 10.7270/Q2GT5QG3
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