BDBM50345548 CHEMBL1784538::[13C,15N-Y,P,V]cyclic CRYPEVEIC::cyclic CRYPEVEIC

SMILES [#6]-[#6]-[#6@H](-[#6])-[#6@@H]-1-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6@@H]-2-[#6]-[#6]-[#6]-[#7]-2-[#6](=O)-[#6@H](-[#6]-c2ccc(-[#8])cc2)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-[#16]-[#16]-[#6]-[#6@H](-[#7]-[#6]-1=O)-[#6](-[#8])=O)-[#6](-[#6])-[#6]

InChI Key InChIKey=LBDSSSXFIWOHDI-UHFFFAOYSA-N

Data  2 KI  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50345548   

TargetPeptidyl-prolyl cis-trans isomerase NIMA-interacting 1(Human)
Horizon Discovery

Curated by ChEMBL
LigandPNGBDBM50345548([13C,15N-Y,P,V]cyclic CRYPEVEIC | cyclic CRYPEVEIC...)
Affinity DataIC50: 500nMAssay Description:Inhibition of GST-tagged Pin1 (unknown origin) using Suc-AEPF-pNA and WFYpSPR-pNA as substrate after 5 minsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/13/2014
Entry Details Article
PubMed
TargetPeptidyl-prolyl cis-trans isomerase NIMA-interacting 1(Human)
Horizon Discovery

Curated by ChEMBL
LigandPNGBDBM50345548([13C,15N-Y,P,V]cyclic CRYPEVEIC | cyclic CRYPEVEIC...)
Affinity DataKi:  200nMAssay Description:Competitive inhibition of human GST-tagged-Pin1 PPIase activity using WFYpSPR-pNA as substrate by Michaelis-Menten equationMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/5/2011
Entry Details Article
PubMed
TargetPeptidyl-prolyl cis-trans isomerase NIMA-interacting 1(Human)
Horizon Discovery

Curated by ChEMBL
LigandPNGBDBM50345548([13C,15N-Y,P,V]cyclic CRYPEVEIC | cyclic CRYPEVEIC...)
Affinity DataKi:  520nMAssay Description:Inhibition of human GST-tagged-Pin1 PPIase activity using Suc-AEPF-pNA as substrate by Michaelis-Menten equationMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/5/2011
Entry Details Article
PubMed