BDBM50144818 2,3,5,6-Tetrafluoro-N-{4-[2-(4-sulfamoyl-phenyl)-ethylsulfamoyl]-phenyl}-benzamide::CHEMBL76626

SMILES: NS(=O)(=O)c1ccc(CCNS(=O)(=O)c2ccc(NC(=O)c3c(F)c(F)cc(F)c3F)cc2)cc1

InChI Key: InChIKey=HFBOFILREKLDAP-UHFFFAOYSA-N

Data: 6 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 6 hits for monomerid = 50144818   

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 9 (Homo sapiens (Human))	BDBM50144818 (2,3,5,6-Tetrafluoro-N-{4-[2-(4-sulfamoyl-phenyl)-e...) Show SMILES NS(=O)(=O)c1ccc(CCNS(=O)(=O)c2ccc(NC(=O)c3c(F)c(F)cc(F)c3F)cc2)cc1 Show InChI InChI=1S/C21H17F4N3O5S2/c22-16-11-17(23)20(25)18(19(16)24)21(29)28-13-3-7-15(8-4-13)35(32,33)27-10-9-12-1-5-14(6-2-12)34(26,30)31/h1-8,11,27H,9-10H2,(H,28,29)(H2,26,30,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	7.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibitory activity against human carbonic anhydrase IX				Bioorg Med Chem Lett 14: 2351-6 (2004) Article DOI: 10.1016/j.bmcl.2004.01.095 BindingDB Entry DOI: 10.7270/Q2D21Z4S
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50144818 (2,3,5,6-Tetrafluoro-N-{4-[2-(4-sulfamoyl-phenyl)-e...) Show SMILES NS(=O)(=O)c1ccc(CCNS(=O)(=O)c2ccc(NC(=O)c3c(F)c(F)cc(F)c3F)cc2)cc1 Show InChI InChI=1S/C21H17F4N3O5S2/c22-16-11-17(23)20(25)18(19(16)24)21(29)28-13-3-7-15(8-4-13)35(32,33)27-10-9-12-1-5-14(6-2-12)34(26,30)31/h1-8,11,27H,9-10H2,(H,28,29)(H2,26,30,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	13	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description In vitro inhibitory activity against human carbonic anhydrase II (hCAII)				J Med Chem 47: 2796-804 (2004) Article DOI: 10.1021/jm031116j BindingDB Entry DOI: 10.7270/Q26974BC
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50144818 (2,3,5,6-Tetrafluoro-N-{4-[2-(4-sulfamoyl-phenyl)-e...) Show SMILES NS(=O)(=O)c1ccc(CCNS(=O)(=O)c2ccc(NC(=O)c3c(F)c(F)cc(F)c3F)cc2)cc1 Show InChI InChI=1S/C21H17F4N3O5S2/c22-16-11-17(23)20(25)18(19(16)24)21(29)28-13-3-7-15(8-4-13)35(32,33)27-10-9-12-1-5-14(6-2-12)34(26,30)31/h1-8,11,27H,9-10H2,(H,28,29)(H2,26,30,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	13	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibitory activity against human carbonic anhydrase II				Bioorg Med Chem Lett 14: 2351-6 (2004) Article DOI: 10.1016/j.bmcl.2004.01.095 BindingDB Entry DOI: 10.7270/Q2D21Z4S
					More data for this Ligand-Target Pair
Carbonic anhydrase 4 (Bos taurus (bovine))	BDBM50144818 (2,3,5,6-Tetrafluoro-N-{4-[2-(4-sulfamoyl-phenyl)-e...) Show SMILES NS(=O)(=O)c1ccc(CCNS(=O)(=O)c2ccc(NC(=O)c3c(F)c(F)cc(F)c3F)cc2)cc1 Show InChI InChI=1S/C21H17F4N3O5S2/c22-16-11-17(23)20(25)18(19(16)24)21(29)28-13-3-7-15(8-4-13)35(32,33)27-10-9-12-1-5-14(6-2-12)34(26,30)31/h1-8,11,27H,9-10H2,(H,28,29)(H2,26,30,31)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	49	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description In vitro inhibitory activity against bovine carbonic anhydrase IV (CAIV)				J Med Chem 47: 2796-804 (2004) Article DOI: 10.1021/jm031116j BindingDB Entry DOI: 10.7270/Q26974BC
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50144818 (2,3,5,6-Tetrafluoro-N-{4-[2-(4-sulfamoyl-phenyl)-e...) Show SMILES NS(=O)(=O)c1ccc(CCNS(=O)(=O)c2ccc(NC(=O)c3c(F)c(F)cc(F)c3F)cc2)cc1 Show InChI InChI=1S/C21H17F4N3O5S2/c22-16-11-17(23)20(25)18(19(16)24)21(29)28-13-3-7-15(8-4-13)35(32,33)27-10-9-12-1-5-14(6-2-12)34(26,30)31/h1-8,11,27H,9-10H2,(H,28,29)(H2,26,30,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	6.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description In vitro inhibitory activity against human carbonic anhydrase I (hCAI)				J Med Chem 47: 2796-804 (2004) Article DOI: 10.1021/jm031116j BindingDB Entry DOI: 10.7270/Q26974BC
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50144818 (2,3,5,6-Tetrafluoro-N-{4-[2-(4-sulfamoyl-phenyl)-e...) Show SMILES NS(=O)(=O)c1ccc(CCNS(=O)(=O)c2ccc(NC(=O)c3c(F)c(F)cc(F)c3F)cc2)cc1 Show InChI InChI=1S/C21H17F4N3O5S2/c22-16-11-17(23)20(25)18(19(16)24)21(29)28-13-3-7-15(8-4-13)35(32,33)27-10-9-12-1-5-14(6-2-12)34(26,30)31/h1-8,11,27H,9-10H2,(H,28,29)(H2,26,30,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	6.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibitory activity against human carbonic anhydrase I				Bioorg Med Chem Lett 14: 2351-6 (2004) Article DOI: 10.1016/j.bmcl.2004.01.095 BindingDB Entry DOI: 10.7270/Q2D21Z4S
					More data for this Ligand-Target Pair