BDBM50012226 5-(1-Oxo-1lambda*4*-thiomorpholin-4-ylmethyl)-thieno[2,3-b]thiophene-2-sulfonic acid amide::CHEMBL52944

SMILES: NS(=O)(=O)c1cc2cc(CN3CCS(=O)CC3)sc2s1

InChI Key: InChIKey=FJKDQGNFFZKEKB-UHFFFAOYSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50012226   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50012226 (5-(1-Oxo-1lambda*4*-thiomorpholin-4-ylmethyl)-thie...) Show SMILES NS(=O)(=O)c1cc2cc(CN3CCS(=O)CC3)sc2s1 Show InChI InChI=1S/C11H14N2O3S4/c12-20(15,16)10-6-8-5-9(17-11(8)18-10)7-13-1-3-19(14)4-2-13/h5-6H,1-4,7H2,(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	3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp and Dohme Research Laboratories Curated by ChEMBL					Assay Description In vitro binding affinity against human carbonic anhydrase II				J Med Chem 34: 1805-18 (1991) Checked by Author BindingDB Entry DOI: 10.7270/Q25D8SFP
					More data for this Ligand-Target Pair