Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 9' and Ligand = 'BDBM50167415'   

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))	BDBM50167415 (CHEMBL371127 | sulfanilamide derivative) Show SMILES Cc1ccc2OC=C3CN(c4ccc(cc4)S(N)(=O)=O)[Zn]4(Cl)(Cl)(OC3c2c1)OC1C(CN4c2ccc(cc2)S(N)(=O)=O)=COc2ccc(C)cc12 |c:47,t:6| Show InChI InChI=1S/2C17H16N2O4S.2ClH.Zn/c2*1-11-2-7-16-15(8-11)17(20)12(10-23-16)9-19-13-3-5-14(6-4-13)24(18,21)22;;;/h2*2-8,10,17H,9H2,1H3,(H2,18,21,22);2*1H;/q2*-2;;;+6/p-2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Ospedale San Lazzaro Curated by ChEMBL					Assay Description Inhibition constant against human carbonic anhydrase IX				Bioorg Med Chem Lett 15: 3096-101 (2005) Article DOI: 10.1016/j.bmcl.2005.04.055 BindingDB Entry DOI: 10.7270/Q27M07FQ
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