BDBM50228110 3-((4,5-dihydroisoxazol-3-yl)methylthio)-5-methyl-4-phenyl-4H-1,2,4-triazole::CHEMBL237815

SMILES Cc1nnc(SCC2=NOCC2)n1-c1ccccc1

InChI Key InChIKey=BDKYRTDORDPHPL-UHFFFAOYSA-N

Data  1 Kd

  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 = 50228110   

TargetPeptidyl-prolyl cis-trans isomerase FKBP1A(Homo sapiens (Human))
University Of California San Diego

Curated by ChEMBL
LigandPNGBDBM50228110(3-((4,5-dihydroisoxazol-3-yl)methylthio)-5-methyl-...)
Affinity DataKd:  3.90E+4nMAssay Description:Binding affinity to human FKBP12 expressed in Escherichia coli BL21(DE3) by isothermal titration calorimetryMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed