BDBM50273194 1-[(3-methylbenzene)sulfonyl]-3-(2-{[2-({[(3-methylbenzene)sulfonyl]carbamoyl}amino)ethyl]disulfanyl}ethyl)urea::CHEMBL458056

SMILES: Cc1cccc(c1)S(=O)(=O)NC(=O)NCCSSCCNC(=O)NS(=O)(=O)c1cccc(C)c1

InChI Key: InChIKey=STZYRUHZZBAWLL-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 = 50273194   

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
Fructose-1,6-bisphosphatase 1 (FBPase) (Homo sapiens (Human))	BDBM50273194 (1-[(3-methylbenzene)sulfonyl]-3-(2-{[2-({[(3-methy...) Show SMILES Cc1cccc(c1)S(=O)(=O)NC(=O)NCCSSCCNC(=O)NS(=O)(=O)c1cccc(C)c1 Show InChI InChI=1S/C20H26N4O6S4/c1-15-5-3-7-17(13-15)33(27,28)23-19(25)21-9-11-31-32-12-10-22-20(26)24-34(29,30)18-8-4-6-16(2)14-18/h3-8,13-14H,9-12H2,1-2H3,(H2,21,23,25)(H2,22,24,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Inhibition of human liver fructose-1,6-bisphosphatase in presence of fructose-2,6-bisphosphate				Bioorg Med Chem Lett 18: 4708-12 (2008) Article DOI: 10.1016/j.bmcl.2008.06.103 BindingDB Entry DOI: 10.7270/Q26W99W7
					More data for this Ligand-Target Pair
Fructose-1,6-bisphosphatase 1 (FBPase) (Homo sapiens (Human))	BDBM50273194 (1-[(3-methylbenzene)sulfonyl]-3-(2-{[2-({[(3-methy...) Show SMILES Cc1cccc(c1)S(=O)(=O)NC(=O)NCCSSCCNC(=O)NS(=O)(=O)c1cccc(C)c1 Show InChI InChI=1S/C20H26N4O6S4/c1-15-5-3-7-17(13-15)33(27,28)23-19(25)21-9-11-31-32-12-10-22-20(26)24-34(29,30)18-8-4-6-16(2)14-18/h3-8,13-14H,9-12H2,1-2H3,(H2,21,23,25)(H2,22,24,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	29	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Inhibition of human liver fructose-1,6-bisphosphatase				Bioorg Med Chem Lett 18: 4708-12 (2008) Article DOI: 10.1016/j.bmcl.2008.06.103 BindingDB Entry DOI: 10.7270/Q26W99W7
					More data for this Ligand-Target Pair