BDBM50086427 (S)-1-(4,4-Dimethyl-2-oxo-pentanoyl)-piperidine-2-carboxylic acid 1-(2-{3-[3-carboxy-4-(6-hydroxy-3-oxo-3H-xanthen-9-yl)-phenyl]-thioureido}-ethyl)-4-phenyl-butyl ester::CHEMBL155511

SMILES [#6]C([#6])([#6])[#6]-[#6](=O)-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6]-[#6@H]-1-[#6](=O)-[#8]-[#6](-[#6]-[#6]-[#6]-c1ccccc1)-[#6]-[#6]-[#7]-[#6](=S)-[#7]=[#6]-1-[#6]=[#6]\[#6](-[#6](=[#6]-1)-[#6](-[#8])=O)=[#6]-1\c2ccc(-[#8])cc2-[#8]-c2cc(-[#8])ccc-12

InChI Key InChIKey=SJLHURSJMQWDHY-UHFFFAOYSA-N

Data  1 KI  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 2 hits for monomerid = 50086427   

TargetPeptidyl-prolyl cis-trans isomerase FKBP1A(Human)
Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL
LigandPNGBDBM50086427((S)-1-(4,4-Dimethyl-2-oxo-pentanoyl)-piperidine-2-...)
Affinity DataIC50: 250nMAssay Description:Binding affinity of compound for FK506 binding protein 12More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetPeptidyl-prolyl cis-trans isomerase FKBP1A(Human)
Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL
LigandPNGBDBM50086427((S)-1-(4,4-Dimethyl-2-oxo-pentanoyl)-piperidine-2-...)
Affinity DataKi:  32nMAssay Description:Binding affinity of compound for FK506 binding protein 12More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed