BDBM50135611 3-[3-Methyl-5-sulfamoyl-3H-[1,3,4]thiadiazol-(2E)-ylidenesulfamoyl]-benzoic acid 2-dimethylamino-1-methyl-ethyl ester::CHEMBL95943

SMILES: CC(CN(C)C)OC(=O)c1cccc(c1)S(=O)(=O)\N=c1\sc(nn1C)S(N)(=O)=O

InChI Key: InChIKey=OXSZPKWHXPJDKU-NBVRZTHBSA-N

Data: 3 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 3 hits for monomerid = 50135611   

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))	BDBM50135611 (3-[3-Methyl-5-sulfamoyl-3H-[1,3,4]thiadiazol-(2E)-...) Show SMILES CC(CN(C)C)OC(=O)c1cccc(c1)S(=O)(=O)\N=c1\sc(nn1C)S(N)(=O)=O Show InChI InChI=1S/C15H21N5O6S3/c1-10(9-19(2)3)26-13(21)11-6-5-7-12(8-11)29(24,25)18-14-20(4)17-15(27-14)28(16,22)23/h5-8,10H,9H2,1-4H3,(H2,16,22,23)/b18-14+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi Curated by ChEMBL					Assay Description Inhibitory activity against human carbonic anhydrase II				Bioorg Med Chem Lett 13: 2867-73 (2003) BindingDB Entry DOI: 10.7270/Q2BR8SQ8
					More data for this Ligand-Target Pair
Carbonic Anhydrase IV (Bos taurus (bovine))	BDBM50135611 (3-[3-Methyl-5-sulfamoyl-3H-[1,3,4]thiadiazol-(2E)-...) Show SMILES CC(CN(C)C)OC(=O)c1cccc(c1)S(=O)(=O)\N=c1\sc(nn1C)S(N)(=O)=O Show InChI InChI=1S/C15H21N5O6S3/c1-10(9-19(2)3)26-13(21)11-6-5-7-12(8-11)29(24,25)18-14-20(4)17-15(27-14)28(16,22)23/h5-8,10H,9H2,1-4H3,(H2,16,22,23)/b18-14+	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	12	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi Curated by ChEMBL					Assay Description Inhibitory activity against Carbonic anhydrase IV isolated from bovine lung				Bioorg Med Chem Lett 13: 2867-73 (2003) BindingDB Entry DOI: 10.7270/Q2BR8SQ8
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50135611 (3-[3-Methyl-5-sulfamoyl-3H-[1,3,4]thiadiazol-(2E)-...) Show SMILES CC(CN(C)C)OC(=O)c1cccc(c1)S(=O)(=O)\N=c1\sc(nn1C)S(N)(=O)=O Show InChI InChI=1S/C15H21N5O6S3/c1-10(9-19(2)3)26-13(21)11-6-5-7-12(8-11)29(24,25)18-14-20(4)17-15(27-14)28(16,22)23/h5-8,10H,9H2,1-4H3,(H2,16,22,23)/b18-14+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	18	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi Curated by ChEMBL					Assay Description Inhibitory activity against human carbonic anhydrase I (hCA I)				Bioorg Med Chem Lett 13: 2867-73 (2003) BindingDB Entry DOI: 10.7270/Q2BR8SQ8
					More data for this Ligand-Target Pair