BDBM50317393 5-(Aminosulfonyl)-N-(2-methoxyethyl)-2-[(2-phenylethyl)thio]benzamide::CHEMBL1096821

SMILES: COCCNC(=O)c1cc(ccc1SCCc1ccccc1)S(N)(=O)=O

InChI Key: InChIKey=MBXJFMPDXDLKOS-UHFFFAOYSA-N

Data: 2 IC50

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 2 hits for monomerid = 50317393   

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 4 (Homo sapiens (Human))	BDBM50317393 (5-(Aminosulfonyl)-N-(2-methoxyethyl)-2-[(2-phenyle...) Show SMILES COCCNC(=O)c1cc(ccc1SCCc1ccccc1)S(N)(=O)=O Show InChI InChI=1S/C18H22N2O4S2/c1-24-11-10-20-18(21)16-13-15(26(19,22)23)7-8-17(16)25-12-9-14-5-3-2-4-6-14/h2-8,13H,9-12H2,1H3,(H,20,21)(H2,19,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.91E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Inhibition of carbonic anhydrase 4				Bioorg Med Chem 18: 3307-19 (2010) Article DOI: 10.1016/j.bmc.2010.03.014 BindingDB Entry DOI: 10.7270/Q2SQ91B9
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50317393 (5-(Aminosulfonyl)-N-(2-methoxyethyl)-2-[(2-phenyle...) Show SMILES COCCNC(=O)c1cc(ccc1SCCc1ccccc1)S(N)(=O)=O Show InChI InChI=1S/C18H22N2O4S2/c1-24-11-10-20-18(21)16-13-15(26(19,22)23)7-8-17(16)25-12-9-14-5-3-2-4-6-14/h2-8,13H,9-12H2,1H3,(H,20,21)(H2,19,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	20.2	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Inhibition of carbonic anhydrase 2				Bioorg Med Chem 18: 3307-19 (2010) Article DOI: 10.1016/j.bmc.2010.03.014 BindingDB Entry DOI: 10.7270/Q2SQ91B9
					More data for this Ligand-Target Pair