null

SMILES: NS(=O)(=O)c1ccc(CCNC(=S)NNCCN2CCOCC2)cc1

InChI Key: InChIKey=MRKMLHNHDCYAOC-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50171013   

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 12 (Homo sapiens (Human))	BDBM50171013 (CHEMBL538564 | N-{2-[4-(aminosulfonyl)phenyl]ethyl...) Show SMILES NS(=O)(=O)c1ccc(CCNC(=S)NNCCN2CCOCC2)cc1 Show InChI InChI=1S/C15H25N5O3S2/c16-25(21,22)14-3-1-13(2-4-14)5-6-17-15(24)19-18-7-8-20-9-11-23-12-10-20/h1-4,18H,5-12H2,(H2,16,21,22)(H2,17,19,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universita degli Studi Curated by ChEMBL					Assay Description Inhibitory activity against catalytic domain of human carbonic anhydrase XII				Bioorg Med Chem Lett 15: 3821-7 (2005) Article DOI: 10.1016/j.bmcl.2005.06.054 BindingDB Entry DOI: 10.7270/Q2H132SW
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50171013 (CHEMBL538564 | N-{2-[4-(aminosulfonyl)phenyl]ethyl...) Show SMILES NS(=O)(=O)c1ccc(CCNC(=S)NNCCN2CCOCC2)cc1 Show InChI InChI=1S/C15H25N5O3S2/c16-25(21,22)14-3-1-13(2-4-14)5-6-17-15(24)19-18-7-8-20-9-11-23-12-10-20/h1-4,18H,5-12H2,(H2,16,21,22)(H2,17,19,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universita degli Studi Curated by ChEMBL					Assay Description Inhibitory activity against human carbonic anhydrase II				Bioorg Med Chem Lett 15: 3821-7 (2005) Article DOI: 10.1016/j.bmcl.2005.06.054 BindingDB Entry DOI: 10.7270/Q2H132SW
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50171013 (CHEMBL538564 | N-{2-[4-(aminosulfonyl)phenyl]ethyl...) Show SMILES NS(=O)(=O)c1ccc(CCNC(=S)NNCCN2CCOCC2)cc1 Show InChI InChI=1S/C15H25N5O3S2/c16-25(21,22)14-3-1-13(2-4-14)5-6-17-15(24)19-18-7-8-20-9-11-23-12-10-20/h1-4,18H,5-12H2,(H2,16,21,22)(H2,17,19,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	54	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universita degli Studi Curated by ChEMBL					Assay Description Inhibitory activity against human carbonic anhydrase I				Bioorg Med Chem Lett 15: 3821-7 (2005) Article DOI: 10.1016/j.bmcl.2005.06.054 BindingDB Entry DOI: 10.7270/Q2H132SW
					More data for this Ligand-Target Pair