BDBM50518732 CHEMBL4473488

SMILES OC(=O)[C@@H](CCC(=O)N1CCOCC1)NC(=O)\C=C\c1ccc2ccccc2c1

InChI Key InChIKey=YPETVRDSRIAFAE-UHFFFAOYSA-N

Data  1 KI  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 2 hits for monomerid = 50518732   

TargetPeptidyl-prolyl cis-trans isomerase NIMA-interacting 1(Human)
Nagoya Citi University

Curated by ChEMBL
LigandPNGBDBM50518732(CHEMBL4473488)
Affinity DataKi:  5.47E+3nMAssay Description:Irreversible inhibition of Pin1 (unknown origin) using suc-Ala-Glu-Pro-Phe-pNA as substrate preincubated for 10 mins followed by substrate addition a...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/23/2021
Entry Details Article
PubMed
TargetPeptidyl-prolyl cis-trans isomerase NIMA-interacting 1(Human)
Nagoya Citi University

Curated by ChEMBL
LigandPNGBDBM50518732(CHEMBL4473488)
Affinity DataIC50: 8.90E+3nMAssay Description:Inhibition of Pin1 (unknown origin) using suc-Ala-Glu-Pro-Phe-pNA as substrate preincubated for 10 mins followed by substrate addition and measured f...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/23/2021
Entry Details Article
PubMed