BDBM50481985 CHEMBL1089625

SMILES [H][C@@]12CCCCN1C(=O)[C@]([H])(NC(=O)CN(C)C(=O)[C@@H](C)NC(=O)[C@H](CCC(=O)NC[C@@H](CCCCNC(=O)CCSSC[C@H](NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(O)=O)C(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc3ccccc3c1)N(C)C2=O)[C@@H](C)OP(O)(O)=O

InChI Key InChIKey=FBMDCLBMDROIQD-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50481985   

TargetPeptidyl-prolyl cis-trans isomerase NIMA-interacting 1(Human)
The Ohio State University

Curated by ChEMBL
LigandPNGBDBM50481985(CHEMBL1089625)
Affinity DataIC50: 32nMAssay Description:Inhibition of human Pin1 S16A/Y23A mutant expressed in Escherichia coli BL21(DE3) by chymotrypsin-coupled PPIase inhibition assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/27/2020
Entry Details Article
PubMed