Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 2' and Ligand = 'BDBM50292056'   

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))	BDBM50292056 (CHEMBL414154 | [Carboxymethyl-(2-{carboxymethyl-[2...) Show SMILES NS(=O)(=O)c1nc2ccc(OCCOC(=O)CN(CCN(CC(O)=O)CC(O)=O)CC(O)=O)cc2s1 Show InChI InChI=1S/C19H24N4O11S2/c20-36(31,32)19-21-13-2-1-12(7-14(13)35-19)33-5-6-34-18(30)11-23(10-17(28)29)4-3-22(8-15(24)25)9-16(26)27/h1-2,7H,3-6,8-11H2,(H,24,25)(H,26,27)(H,28,29)(H2,20,31,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.5	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 Inhibitory activity against Human carbonic anhydrase II				J Med Chem 45: 1466-76 (2002) BindingDB Entry DOI: 10.7270/Q2N29XN9
					More data for this Ligand-Target Pair