BDBM50317416 5-(Aminosulfonyl)-N-ethyl-3-fluoro-2-(isopropylthio)-benzamide::CHEMBL1099003

SMILES: CCNC(=O)c1cc(cc(F)c1SC(C)C)S(N)(=O)=O

InChI Key: InChIKey=FGYBFQBXPZITQQ-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 = 50317416   

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))	BDBM50317416 (5-(Aminosulfonyl)-N-ethyl-3-fluoro-2-(isopropylthi...) Show SMILES CCNC(=O)c1cc(cc(F)c1SC(C)C)S(N)(=O)=O Show InChI InChI=1S/C12H17FN2O3S2/c1-4-15-12(16)9-5-8(20(14,17)18)6-10(13)11(9)19-7(2)3/h5-7H,4H2,1-3H3,(H,15,16)(H2,14,17,18)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.89E+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))	BDBM50317416 (5-(Aminosulfonyl)-N-ethyl-3-fluoro-2-(isopropylthi...) Show SMILES CCNC(=O)c1cc(cc(F)c1SC(C)C)S(N)(=O)=O Show InChI InChI=1S/C12H17FN2O3S2/c1-4-15-12(16)9-5-8(20(14,17)18)6-10(13)11(9)19-7(2)3/h5-7H,4H2,1-3H3,(H,15,16)(H2,14,17,18)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.77	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