Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 2' and Ligand = 'BDBM50524784'   

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))	BDBM50524784 (CHEMBL4576825) Show SMILES CCS(=O)(=O)Oc1ccc(cc1)-c1ccc2sccc2c1 Show InChI InChI=1S/C16H14O3S2/c1-2-21(17,18)19-15-6-3-12(4-7-15)13-5-8-16-14(11-13)9-10-20-16/h3-11H,2H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Sharjah Curated by ChEMBL					Assay Description Inhibition of human recombinant N-HA-tagged carbonic anhydrase 2 expressed in HEK293T cells using p-nitrophenyl acetate as substrate measured after 3...				Bioorg Med Chem 27: 3889-3901 (2019) Article DOI: 10.1016/j.bmc.2019.07.026 BindingDB Entry DOI: 10.7270/Q2GX4G0K
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