Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 2' and Ligand = 'BDBM50101337'   

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))	BDBM50101337 ((S)-4-Methyl-2-(4-sulfamoyl-benzoylamino)-pentanoi...) Show SMILES CC(C)C[C@H](NC(=O)c1ccc(cc1)S(N)(=O)=O)C(O)=O Show InChI InChI=1S/C13H18N2O5S/c1-8(2)7-11(13(17)18)15-12(16)9-3-5-10(6-4-9)21(14,19)20/h3-6,8,11H,7H2,1-2H3,(H,15,16)(H,17,18)(H2,14,19,20)/t11-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	53	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi Curated by ChEMBL					Assay Description Binding affinity against human carbonic anhydrase II (hCA -II)				Bioorg Med Chem Lett 11: 1787-91 (2001) BindingDB Entry DOI: 10.7270/Q2K64JM5
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50101337 ((S)-4-Methyl-2-(4-sulfamoyl-benzoylamino)-pentanoi...) Show SMILES CC(C)C[C@H](NC(=O)c1ccc(cc1)S(N)(=O)=O)C(O)=O Show InChI InChI=1S/C13H18N2O5S/c1-8(2)7-11(13(17)18)15-12(16)9-3-5-10(6-4-9)21(14,19)20/h3-6,8,11H,7H2,1-2H3,(H,15,16)(H,17,18)(H2,14,19,20)/t11-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Dissociation constant against human carbonic anhydrase II at 37 degree centigrade				Bioorg Med Chem Lett 6: 559-564 (1996) Article DOI: 10.1016/0960-894X(96)00069-8 BindingDB Entry DOI: 10.7270/Q2V124SF
					More data for this Ligand-Target Pair