Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 2' and Ligand = 'BDBM50240689'   

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))	BDBM50240689 (2,6-Di-tert-butyl-4-methoxy-phenol | 2,6-di-tert-b...) Show SMILES COc1cc(c(O)c(c1)C(C)(C)C)C(C)(C)C Show InChI InChI=1S/C15H24O2/c1-14(2,3)11-8-10(17-7)9-12(13(11)16)15(4,5)6/h8-9,16H,1-7H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	420	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Ataturk University Curated by ChEMBL					Assay Description Inhibition of human erythrocyte CA2 esterase activity using 4-nitrophenyl acetate substrate				Bioorg Med Chem 17: 3207-11 (2009) Article DOI: 10.1016/j.bmc.2009.01.067 BindingDB Entry DOI: 10.7270/Q2N58M7V
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