BDBM40278 2-[5-(4-Chloro-phenoxymethyl)-4-methyl-4H-[1,2,4]triazol-3-ylsulfanyl]-N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-acetamide::2-[[5-[(4-chloranylphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-cyano-4,5-dimethyl-thiophen-2-yl)ethanamide::2-[[5-[(4-chlorophenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-cyano-4,5-dimethylthiophen-2-yl)acetamide::2-[[5-[(4-chlorophenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]-N-(3-cyano-4,5-dimethyl-2-thienyl)acetamide::2-[[5-[(4-chlorophenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]-N-(3-cyano-4,5-dimethyl-2-thiophenyl)acetamide::MLS000077088::SMR000001998::cid_651987

SMILES Cc1sc(NC(=O)CSc2nnc(COc3ccc(Cl)cc3)n2C)c(C#N)c1C

InChI Key InChIKey=XZKAHRMBFKDBMP-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 40278   

TargetUbiquitin carboxyl-terminal hydrolase BAP1(Homo sapiens (Human))
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM40278(2-[5-(4-Chloro-phenoxymethyl)-4-methyl-4H-[1,2,4]t...)
Affinity DataIC50: >5.00E+4nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Keith D. Wilkinson, Emory ...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay