BDBM89452 3-(methylsulfamoyl)benzoic acid [2-[2,5-dimethyl-1-(2-oxolanylmethyl)-3-pyrrolyl]-2-oxoethyl] ester::3-(methylsulfamoyl)benzoic acid [2-[2,5-dimethyl-1-(tetrahydrofurfuryl)pyrrol-3-yl]-2-keto-ethyl] ester::MLS002162632::SMR001245032::[2-[2,5-dimethyl-1-(oxolan-2-ylmethyl)pyrrol-3-yl]-2-oxidanylidene-ethyl] 3-(methylsulfamoyl)benzoate::[2-[2,5-dimethyl-1-(oxolan-2-ylmethyl)pyrrol-3-yl]-2-oxoethyl] 3-(methylsulfamoyl)benzoate::cid_4314554

SMILES: CNS(=O)(=O)c1cccc(c1)C(=O)OCC(=O)c1cc(C)n(CC2CCCO2)c1C

InChI Key: InChIKey=DIOKRFBXDZEMNS-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 = 89452   

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
Protein Wnt-3a (Mus musculus)	BDBM89452 (3-(methylsulfamoyl)benzoic acid [2-[2,5-dimethyl-1...) Show SMILES CNS(=O)(=O)c1cccc(c1)C(=O)OCC(=O)c1cc(C)n(CC2CCCO2)c1C Show InChI InChI=1S/C21H26N2O6S/c1-14-10-19(15(2)23(14)12-17-7-5-9-28-17)20(24)13-29-21(25)16-6-4-8-18(11-16)30(26,27)22-3/h4,6,8,10-11,17,22H,5,7,9,12-13H2,1-3H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.89E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay									PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q25B012X
					More data for this Ligand-Target Pair
Zinc finger protein GLI1 (Mus musculus)	BDBM89452 (3-(methylsulfamoyl)benzoic acid [2-[2,5-dimethyl-1...) Show SMILES CNS(=O)(=O)c1cccc(c1)C(=O)OCC(=O)c1cc(C)n(CC2CCCO2)c1C Show InChI InChI=1S/C21H26N2O6S/c1-14-10-19(15(2)23(14)12-17-7-5-9-28-17)20(24)13-29-21(25)16-6-4-8-18(11-16)30(26,27)22-3/h4,6,8,10-11,17,22H,5,7,9,12-13H2,1-3H3	PDB MMDB B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	735	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q2862F26
					More data for this Ligand-Target Pair