BDBM50095915 CHEMBL3590354

SMILES [H][C@@]12CCCN1C(=O)c1cc3cc(c1)C(=O)NC[C@]([H])(NC(=O)[C@@H](CC(O)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccc4ccccc4c1)NC(=O)[C@@]1([H])CCCCN1C(=O)[C@@H](CC(O)=O)NC(=O)CN(C)C2=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc2ccccc2c1)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](CNC3=O)C(=O)N[C@@H](CCCCN)C(O)=O

InChI Key InChIKey=WEPUZIQJMHMFOF-ZOPYNWFKSA-N

Data  1 Kd

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50095915   

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

Curated by ChEMBL
LigandPNGBDBM50095915(CHEMBL3590354)
Affinity DataKd:  4.60E+3nMAssay Description:Binding affinity to N-terminal MBP fused and Texas-red-labeled full-length human Pin1 S16A/Y23A mutant expressed in Escherichia coli assessed as incr...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed