Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 2' and Ligand = 'BDBM50248564'   

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))	BDBM50248564 (CHEMBL4069637) Show SMILES Cc1ccc(cc1)S(=O)(=O)Nc1cc(C)ccc1[Se][Se]c1ccc(C)cc1NS(=O)(=O)c1ccc(C)cc1 Show InChI InChI=1S/C28H28N2O4S2Se2/c1-19-5-11-23(12-6-19)35(31,32)29-25-17-21(3)9-15-27(25)37-38-28-16-10-22(4)18-26(28)30-36(33,34)24-13-7-20(2)8-14-24/h5-18,29-30H,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	3.09E+4	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 Inhibition of recombinant human cytosolic carbonic anhydrase 2 pretreated for 15 mins prior to testing measured for 10 to 100 secs by phenol red base...				Bioorg Med Chem 25: 2518-2523 (2017) Article DOI: 10.1016/j.bmc.2017.03.013 BindingDB Entry DOI: 10.7270/Q25B04XC
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