Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 2' and Ligand = 'BDBM50097291'   

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))	BDBM50097291 (CHEMBL284398 | {{2-[Carboxymethyl-(2-{carboxymethy...) Show SMILES NS(=O)(=O)c1ccc(NC(=O)CN(CCN(CCN(CC(O)=O)CC(=O)Nc2ccc(cc2Cl)S(N)(=O)=O)CC(O)=O)CC(O)=O)c(Cl)c1 Show InChI InChI=1S/C26H33Cl2N7O12S2/c27-18-9-16(48(29,44)45)1-3-20(18)31-22(36)11-34(14-25(40)41)7-5-33(13-24(38)39)6-8-35(15-26(42)43)12-23(37)32-21-4-2-17(10-19(21)28)49(30,46)47/h1-4,9-10H,5-8,11-15H2,(H,31,36)(H,32,37)(H,38,39)(H,40,41)(H,42,43)(H2,29,44,45)(H2,30,46,47)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	15	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
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50097291 (CHEMBL284398 | {{2-[Carboxymethyl-(2-{carboxymethy...) Show SMILES NS(=O)(=O)c1ccc(NC(=O)CN(CCN(CCN(CC(O)=O)CC(=O)Nc2ccc(cc2Cl)S(N)(=O)=O)CC(O)=O)CC(O)=O)c(Cl)c1 Show InChI InChI=1S/C26H33Cl2N7O12S2/c27-18-9-16(48(29,44)45)1-3-20(18)31-22(36)11-34(14-25(40)41)7-5-33(13-24(38)39)6-8-35(15-26(42)43)12-23(37)32-21-4-2-17(10-19(21)28)49(30,46)47/h1-4,9-10H,5-8,11-15H2,(H,31,36)(H,32,37)(H,38,39)(H,40,41)(H,42,43)(H2,29,44,45)(H2,30,46,47)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi Curated by ChEMBL					Assay Description Inhibition of cloned isozyme, human carbonic anhydrase II				Bioorg Med Chem Lett 11: 575-82 (2001) BindingDB Entry DOI: 10.7270/Q2KW5GJQ
					More data for this Ligand-Target Pair