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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Estrogen receptor' and Ligand = 'BDBM50121606'   
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
Estrogen receptor


(Homo sapiens (Human))
BDBM50121606
PNG
(4-{2-[4-(3-Phenyl-propylamino)-6-piperazin-1-yl-[1...)
Show SMILES Oc1ccc(CCNc2nc(NCCCc3ccccc3)nc(n2)N2CCNCC2)cc1
Show InChI InChI=1S/C24H31N7O/c32-21-10-8-20(9-11-21)12-14-27-23-28-22(26-13-4-7-19-5-2-1-3-6-19)29-24(30-23)31-17-15-25-16-18-31/h1-3,5-6,8-11,25,32H,4,7,12-18H2,(H2,26,27,28,29,30)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
1.38E+3n/an/an/an/an/an/an/an/a



GlaxoSmithKline Research and Development

Curated by ChEMBL


Assay Description
In vitro binding affinity towards human Estrogen receptor alpha using [3H]-17-beta-estradiol as radioligand


J Med Chem 45: 5492-505 (2002)


BindingDB Entry DOI: 10.7270/Q2J965RW
More data for this
Ligand-Target Pair