Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 2' and Ligand = 'BDBM50038967'   

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 2 (Homo sapiens (Human))	BDBM50038967 (CHEMBL65489 | N-Phenylsulfanylmethyl-4-sulfamoyl-b...) Show SMILES NS(=O)(=O)c1ccc(cc1)C(=O)NCSc1ccccc1 Show InChI InChI=1S/C14H14N2O3S2/c15-21(18,19)13-8-6-11(7-9-13)14(17)16-10-20-12-4-2-1-3-5-12/h1-9H,10H2,(H,16,17)(H2,15,18,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	1.70	n/a	n/a	n/a	n/a	n/a
Harvard University Curated by ChEMBL					Assay Description Dissociation constant against human Carbonic anhydrase II (HCA II)				J Med Chem 37: 2100-5 (1994) BindingDB Entry DOI: 10.7270/Q2TX3DDV
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