Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 12' and Ligand = 'BDBM50263419'   

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 12 (Homo sapiens (Human))	BDBM50263419 (4-(2-(2-(7-methoxy-2-oxo-2H-chromen-4-yl)acetyl)hy...) Show SMILES COc1ccc2c(CC(=O)NNc3ccc(cc3)S(N)(=O)=O)cc(=O)oc2c1 Show InChI InChI=1S/C18H17N3O6S/c1-26-13-4-7-15-11(9-18(23)27-16(15)10-13)8-17(22)21-20-12-2-5-14(6-3-12)28(19,24)25/h2-7,9-10,20H,8H2,1H3,(H,21,22)(H2,19,24,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	78	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Florida Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase 12 catalytic domain preincubated for 15 mins by CO2 hydration method				Bioorg Med Chem 18: 4873-8 (2010) Article DOI: 10.1016/j.bmc.2010.06.028 BindingDB Entry DOI: 10.7270/Q2D21ZKM
					More data for this Ligand-Target Pair