BDBM50146761 5-(3-Pentafluorophenyl-ureido)-[1,3,4]thiadiazole-2-sulfonic acid amide::CHEMBL317890

SMILES: NS(=O)(=O)c1nnc(NC(=O)Nc2c(F)c(F)c(F)c(F)c2F)s1

InChI Key: InChIKey=SFNUIOHIVSABQR-UHFFFAOYSA-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 = 50146761   

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))	BDBM50146761 (5-(3-Pentafluorophenyl-ureido)-[1,3,4]thiadiazole-...) Show SMILES NS(=O)(=O)c1nnc(NC(=O)Nc2c(F)c(F)c(F)c(F)c2F)s1 Show InChI InChI=1S/C9H4F5N5O3S2/c10-1-2(11)4(13)6(5(14)3(1)12)16-7(20)17-8-18-19-9(23-8)24(15,21)22/h(H2,15,21,22)(H2,16,17,18,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	3.60	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 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 4 (Bos taurus (bovine))	BDBM50146761 (5-(3-Pentafluorophenyl-ureido)-[1,3,4]thiadiazole-...) Show SMILES NS(=O)(=O)c1nnc(NC(=O)Nc2c(F)c(F)c(F)c(F)c2F)s1 Show InChI InChI=1S/C9H4F5N5O3S2/c10-1-2(11)4(13)6(5(14)3(1)12)16-7(20)17-8-18-19-9(23-8)24(15,21)22/h(H2,15,21,22)(H2,16,17,18,20)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	45	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))	BDBM50146761 (5-(3-Pentafluorophenyl-ureido)-[1,3,4]thiadiazole-...) Show SMILES NS(=O)(=O)c1nnc(NC(=O)Nc2c(F)c(F)c(F)c(F)c2F)s1 Show InChI InChI=1S/C9H4F5N5O3S2/c10-1-2(11)4(13)6(5(14)3(1)12)16-7(20)17-8-18-19-9(23-8)24(15,21)22/h(H2,15,21,22)(H2,16,17,18,20)	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	270	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