BDBM50452588 CHEMBL2092885

SMILES: Cl.CCN[C@@H]1CCS(=O)(=O)c2sc(cc12)S(N)(=O)=O

InChI Key: InChIKey=KJFXPPJDMGRIMI-OGFXRTJISA-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 = 50452588   

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))	BDBM50452588 (CHEMBL2092885) Show SMILES Cl.CCN[C@@H]1CCS(=O)(=O)c2sc(cc12)S(N)(=O)=O |r| Show InChI InChI=1S/C9H14N2O4S3.ClH/c1-2-11-7-3-4-17(12,13)9-6(7)5-8(16-9)18(10,14)15;/h5,7,11H,2-4H2,1H3,(H2,10,14,15);1H/t7-;/m1./s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp and Dohme-Chibret Curated by ChEMBL					Assay Description 50% inhibitory concentration against human carbonic anhydrase II (HCA II) after pre-incubation at 3 degree C				J Med Chem 32: 2510-3 (1989) BindingDB Entry DOI: 10.7270/Q29W0G22
					More data for this Ligand-Target Pair