BDBM50575664 CHEMBL4868302

SMILES COc1ccc(cc1OC)CC[C@@H]2c3cccc(c3)OC/C=C/COc4cc(cc(c4OC)OC)[C@@H](C(=O)N5CCCC[C@H]5C(=O)O2)C6CCCCC6

InChI Key InChIKey=NDUCBUBAJQQVOX-UHFFFAOYSA-N

Data  4 Kd

PDB links: 1 PDB ID matches this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50575664   

TargetPeptidyl-prolyl cis-trans isomerase FKBP5(Human)
Technical University Darmstadt

Curated by ChEMBL
LigandPNGBDBM50575664(CHEMBL4868302)
Affinity DataKd:  108nMAssay Description:Displacement of fluorescent tracer 5-(3-(4-((1S,5S,6S)-10-(3,5-dichlorophenylsulfonyl)-2-oxo-3-(pyridin-3-ylmethyl)-3,10-diazabicyclo[4.3.1]decan-5-y...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2022
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetPeptidyl-prolyl cis-trans isomerase FKBP4(Human)
Technical University Darmstadt

Curated by ChEMBL
LigandPNGBDBM50575664(CHEMBL4868302)
Affinity DataKd:  5.40E+3nMAssay Description:Displacement of fluorescent tracer 5-(3-(4-((1S,5S,6S)-10-(3,5-dichlorophenylsulfonyl)-2-oxo-3-(pyridin-3-ylmethyl)-3,10-diazabicyclo[4.3.1]decan-5-y...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2022
Entry Details Article
PubMed
TargetPeptidyl-prolyl cis-trans isomerase FKBP1A(Human)
Technical University Darmstadt

Curated by ChEMBL
LigandPNGBDBM50575664(CHEMBL4868302)
Affinity DataKd:  212nMAssay Description:Displacement of fluorescent tracer 5-(3-(4-((1S,5S,6S)-10-(3,5-dichlorophenylsulfonyl)-2-oxo-3-(pyridin-3-ylmethyl)-3,10-diazabicyclo[4.3.1]decan-5-y...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2022
Entry Details Article
PubMed
TargetPeptidyl-prolyl cis-trans isomerase FKBP1B(Human)
Technical University Darmstadt

Curated by ChEMBL
LigandPNGBDBM50575664(CHEMBL4868302)
Affinity DataKd:  216nMAssay Description:Displacement of fluorescent tracer 5-(3-(4-((1S,5S,6S)-10-(3,5-dichlorophenylsulfonyl)-2-oxo-3-(pyridin-3-ylmethyl)-3,10-diazabicyclo[4.3.1]decan-5-y...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2022
Entry Details Article
PubMed