Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 2' and Ligand = 'BDBM11417'   

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))	BDBM11417 (2H-Thieno[3,2-e]-1,2-thiazine-6-sulfonamide 1,1-di...) Show SMILES COCCCN1C(CNC2CC2)=Cc2cc(sc2S1(=O)=O)S(N)(=O)=O |c:12| Show InChI InChI=1S/C14H21N3O5S3/c1-22-6-2-5-17-12(9-16-11-3-4-11)7-10-8-13(24(15,18)19)23-14(10)25(17,20)21/h7-8,11,16H,2-6,9H2,1H3,(H2,15,18,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	0.260	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alcon Research, Ltd.					Assay Description Inhibitor binding to CA II was determined using a fluorescence competition assay. Displacement of dansylamide and binding of the inhibitor was determ...				Bioorg Med Chem 8: 957-75 (2000) Article DOI: 10.1016/s0968-0896(00)00026-2 BindingDB Entry DOI: 10.7270/Q23B5XC0
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM11417 (2H-Thieno[3,2-e]-1,2-thiazine-6-sulfonamide 1,1-di...) Show SMILES COCCCN1C(CNC2CC2)=Cc2cc(sc2S1(=O)=O)S(N)(=O)=O |c:12| Show InChI InChI=1S/C14H21N3O5S3/c1-22-6-2-5-17-12(9-16-11-3-4-11)7-10-8-13(24(15,18)19)23-14(10)25(17,20)21/h7-8,11,16H,2-6,9H2,1H3,(H2,15,18,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.12	n/a	n/a	n/a	n/a	n/a	n/a
Alcon Research, Ltd.					Assay Description The assay measured the rate of CO2 hydration by determining the addition rate of a NaOH solution using a Radiometer VIT 90 titration system. The enzy...				Bioorg Med Chem 8: 957-75 (2000) Article DOI: 10.1016/s0968-0896(00)00026-2 BindingDB Entry DOI: 10.7270/Q23B5XC0
					More data for this Ligand-Target Pair