Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 2' and Ligand = 'BDBM50097283'   

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))	BDBM50097283 (CHEMBL284831 | {{2-[Carboxymethyl-(2-{carboxymethy...) Show SMILES NS(=O)(=O)c1cc(c(NC(=O)CN(CCN(CCN(CC(O)=O)CC(=O)Nc2cc(Cl)c(cc2S(N)(=O)=O)S(N)(=O)=O)CC(O)=O)CC(O)=O)cc1Cl)S(N)(=O)=O Show InChI InChI=1S/C26H35Cl2N9O16S4/c27-14-5-16(20(56(31,50)51)7-18(14)54(29,46)47)33-22(38)9-36(12-25(42)43)3-1-35(11-24(40)41)2-4-37(13-26(44)45)10-23(39)34-17-6-15(28)19(55(30,48)49)8-21(17)57(32,52)53/h5-8H,1-4,9-13H2,(H,33,38)(H,34,39)(H,40,41)(H,42,43)(H,44,45)(H2,29,46,47)(H2,30,48,49)(H2,31,50,51)(H2,32,52,53)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	11	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))	BDBM50097283 (CHEMBL284831 | {{2-[Carboxymethyl-(2-{carboxymethy...) Show SMILES NS(=O)(=O)c1cc(c(NC(=O)CN(CCN(CCN(CC(O)=O)CC(=O)Nc2cc(Cl)c(cc2S(N)(=O)=O)S(N)(=O)=O)CC(O)=O)CC(O)=O)cc1Cl)S(N)(=O)=O Show InChI InChI=1S/C26H35Cl2N9O16S4/c27-14-5-16(20(56(31,50)51)7-18(14)54(29,46)47)33-22(38)9-36(12-25(42)43)3-1-35(11-24(40)41)2-4-37(13-26(44)45)10-23(39)34-17-6-15(28)19(55(30,48)49)8-21(17)57(32,52)53/h5-8H,1-4,9-13H2,(H,33,38)(H,34,39)(H,40,41)(H,42,43)(H,44,45)(H2,29,46,47)(H2,30,48,49)(H2,31,50,51)(H2,32,52,53)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	11	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