BDBM50228139 3-(pyridin-3-yl)propyl 4-(2-(4-isopropylphenylthio)acetyl)morpholine-3-carboxylate::CHEMBL235104

SMILES CC(C)c1ccc(SCC(=O)N2CCOCC2C(=O)OCCCc2cccnc2)cc1

InChI Key InChIKey=OEKIMMDQGPSODM-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 = 50228139   

TargetPeptidyl-prolyl cis-trans isomerase FKBP1A(Human)
University of California San Diego

Curated by ChEMBL
LigandPNGBDBM50228139(3-(pyridin-3-yl)propyl 4-(2-(4-isopropylphenylthio...)
Affinity DataKd:  5.60E+3nMAssay Description:Binding affinity to human FKBP12 expressed in Escherichia coli BL21(DE3) by isothermal titration calorimetryMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/11/2009
Entry Details Article
PubMed