Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 2' and Ligand = 'BDBM50088767'   

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))	BDBM50088767 (4-{[(morpholin-4-ylcarbonothioyl)thio]amino}benzen...) Show SMILES NS(=O)(=O)c1ccc(NSC(=S)N2CCOCC2)cc1 Show InChI InChI=1S/C11H15N3O3S3/c12-20(15,16)10-3-1-9(2-4-10)13-19-11(18)14-5-7-17-8-6-14/h1-4,13H,5-8H2,(H2,12,15,16)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	35	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università degli Studi Curated by ChEMBL					Assay Description Binding affinity of compound against human Carbonic anhydrase II				Bioorg Med Chem Lett 10: 1887-91 (2000) BindingDB Entry DOI: 10.7270/Q27S7N1P
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50088767 (4-{[(morpholin-4-ylcarbonothioyl)thio]amino}benzen...) Show SMILES NS(=O)(=O)c1ccc(NSC(=S)N2CCOCC2)cc1 Show InChI InChI=1S/C11H15N3O3S3/c12-20(15,16)10-3-1-9(2-4-10)13-19-11(18)14-5-7-17-8-6-14/h1-4,13H,5-8H2,(H2,12,15,16)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	36	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 human carbonic anhydrase II (hCA II)				Bioorg Med Chem Lett 10: 1117-20 (2000) BindingDB Entry DOI: 10.7270/Q2WW7J6M
					More data for this Ligand-Target Pair