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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Peptidyl-prolyl cis-trans isomerase FKBP5' and Ligand = 'BDBM50125324'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/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))		BDBM50125324
PNG
(CHEMBL3623620)
Show SMILES COc1ccc(CC[C@@H](OC(=O)[C@@H]2CCCCN2C(=O)[C@H](CO)C2CCCCC2)c2cccc(OCCN3CCOCC3)c2)cc1OC |r|
Show InChI InChI=1S/C38H54N2O8/c1-44-35-17-15-28(25-36(35)45-2)14-16-34(30-11-8-12-31(26-30)47-24-21-39-19-22-46-23-20-39)48-38(43)33-13-6-7-18-40(33)37(42)32(27-41)29-9-4-3-5-10-29/h8,11-12,15,17,25-26,29,32-34,41H,3-7,9-10,13-14,16,18-24,27H2,1-2H3/t32-,33+,34-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars
Article
PubMed
 2.00E+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)


Article DOI: 10.1021/acs.jmedchem.5b00785
BindingDB Entry DOI: 10.7270/Q25Q4XWR
More data for this
Ligand-Target Pair