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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Estrogen receptor' and Ligand = 'BDBM50159326'   
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))
BDBM50159326
PNG
(4-{(4S,5R)-5-[4-(2-Dimethylamino-ethoxy)-phenyl]-4...)
Show SMILES CN(C)CCOc1ccc(cc1)[C@H]1NC=N[C@H]1c1ccc(O)cc1 |c:15|
Show InChI InChI=1S/C19H23N3O2/c1-22(2)11-12-24-17-9-5-15(6-10-17)19-18(20-13-21-19)14-3-7-16(23)8-4-14/h3-10,13,18-19,23H,11-12H2,1-2H3,(H,20,21)/t18-,19+/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 3.47E+3n/an/an/an/a



Free University of Berlin

Curated by ChEMBL


Assay Description
Effective concentration against estrogen receptor alpha of MCF-7-2a cells


J Med Chem 48: 466-74 (2005)


Article DOI: 10.1021/jm040855c
BindingDB Entry DOI: 10.7270/Q20864T2
More data for this
Ligand-Target Pair