BDBM50639664 CHEMBL5565884

SMILES CCOc1ccc2cc(C#N)c(SCC(=O)NCCc3ccccc3)nc2c1

InChI Key

  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 2 hits for monomerid = 50639664   

TargetPeptidyl-prolyl cis-trans isomerase FKBP5(Human)
Karolinska Institutet

Curated by ChEMBL
LigandPNGBDBM50639664(CHEMBL5565884)
Affinity DataIC50: 4.00E+3nMAssay Description:Inhibition of GST-tagged human FKBP51 expressed in Escherichia coli BL21 (DE3) using NH2-EDASRMEEVD-COOH peptide as substrate preincubated for 15 min...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
TargetPeptidyl-prolyl cis-trans isomerase FKBP4(Human)
Karolinska Institutet

Curated by ChEMBL
LigandPNGBDBM50639664(CHEMBL5565884)
Affinity DataIC50: 5.00E+3nMAssay Description:Inhibition of GST-tagged human FKBP52 expressed in Escherichia coli BL21 (DE3) using NH2-EDASRMEEVD-COOH peptide as substrate preincubated for 15 min...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed