null

SMILES: NS(=O)(=O)c1nnc(NCc2cn(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)nn2)s1

InChI Key: InChIKey=PGPVLKISGXIRPM-ZEBDFXRSSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50071814   

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))	BDBM50071814 (CHEMBL3410763) Show SMILES NS(=O)(=O)c1nnc(NCc2cn(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)nn2)s1 |r| Show InChI InChI=1S/C11H17N7O8S2/c12-28(23,24)11-16-15-10(27-11)13-1-4-2-18(17-14-4)26-9-8(22)7(21)6(20)5(3-19)25-9/h2,5-9,19-22H,1,3H2,(H,13,15)(H2,12,23,24)/t5-,6-,7+,8-,9+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	2.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Griffith University Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 2 by CO2 hydration assay				J Med Chem 58: 1494-501 (2015) Article DOI: 10.1021/jm501798g BindingDB Entry DOI: 10.7270/Q2RV0QCP
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50071814 (CHEMBL3410763) Show SMILES NS(=O)(=O)c1nnc(NCc2cn(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)nn2)s1 |r| Show InChI InChI=1S/C11H17N7O8S2/c12-28(23,24)11-16-15-10(27-11)13-1-4-2-18(17-14-4)26-9-8(22)7(21)6(20)5(3-19)25-9/h2,5-9,19-22H,1,3H2,(H,13,15)(H2,12,23,24)/t5-,6-,7+,8-,9+/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	87	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Griffith University Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 1 by CO2 hydration assay				J Med Chem 58: 1494-501 (2015) Article DOI: 10.1021/jm501798g BindingDB Entry DOI: 10.7270/Q2RV0QCP
					More data for this Ligand-Target Pair