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BDBM50125325 CHEMBL3623619

SMILES: COCOC[C@H](C1CCCCC1)C(=O)N1CCCC[C@H]1C(=O)O[C@H](CCc1ccc(OC)c(OC)c1)c1cccc(OCCN2CCOCC2)c1

InChI Key: InChIKey=COYXOZFNYZRGSD-ZTJXOPACSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50125325   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Peptidyl-prolyl cis-trans isomerase FKBP5


(Homo sapiens (Human))		BDBM50125325
PNG
(CHEMBL3623619)
Show SMILES COCOC[C@H](C1CCCCC1)C(=O)N1CCCC[C@H]1C(=O)O[C@H](CCc1ccc(OC)c(OC)c1)c1cccc(OCCN2CCOCC2)c1 |r|
Show InChI InChI=1S/C40H58N2O9/c1-45-29-49-28-34(31-10-5-4-6-11-31)39(43)42-19-8-7-14-35(42)40(44)51-36(17-15-30-16-18-37(46-2)38(26-30)47-3)32-12-9-13-33(27-32)50-25-22-41-20-23-48-24-21-41/h9,12-13,16,18,26-27,31,34-36H,4-8,10-11,14-15,17,19-25,28-29H2,1-3H3/t34-,35+,36-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
 4.10E+3n/an/an/an/an/an/an/an/a



Max Planck Institute of Psychiatry

Curated by ChEMBL


Assay Description
Binding affinity to FKBP51 (unknown origin) by competitive fluorescence polarization assay

J Med Chem 58: 7796-806 (2015)


BindingDB Entry DOI: 10.7270/Q25Q4XWR
More data for this
Ligand-Target Pair