BDBM59452 (5Z)-5-(4,5-dimethyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-1,2-dihydropyrazole-3-carboxamide::(5Z)-5-(4,5-dimethyl-6-oxo-1-cyclohexa-2,4-dienylidene)-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-1,2-dihydropyrazole-3-carboxamide::(5Z)-5-(4,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-1,2-dihydropyrazole-3-carboxamide::(5Z)-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-5-(6-keto-4,5-dimethyl-cyclohexa-2,4-dien-1-ylidene)-3-pyrazoline-3-carboxamide::5-(2-Hydroxy-3,4-dimethyl-phenyl)-2H-pyrazole-3-carboxylic acid (5-ethylsulfanyl-[1,3,4]thiadiazol-2-yl)-amide::MLS000332127::SMR000221605::cid_15944670

SMILES CCSc1nnc(NC(=O)c2cc(-c3ccc(C)c(C)c3O)n[nH]2)s1

InChI Key InChIKey=LTTQCUUNKVCQRG-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 59452   

TargetE3 ubiquitin-protein ligase XIAP(Human)
Sanford-Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 59452BDBM59452((5Z)-5-(4,5-dimethyl-6-oxidanylidene-cyclohexa-2,4...)
Affinity DataIC50: 1.00E+5nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/8/2011
Entry Details
PCBioAssay