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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Estrogen receptor' and Ligand = 'BDBM50126767'   
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))		BDBM50126767
PNG
(7-Ethyl-4-methyl-9-[4-(2-piperidin-1-yl-ethoxy)-ph...)
Show SMILES CCc1ccc-2c(c1)C(Cc1cc(O)cc(C)c-21)c1ccc(OCCN2CCCCC2)cc1
Show InChI InChI=1S/C30H35NO2/c1-3-22-7-12-27-29(18-22)28(20-24-19-25(32)17-21(2)30(24)27)23-8-10-26(11-9-23)33-16-15-31-13-5-4-6-14-31/h7-12,17-19,28,32H,3-6,13-16,20H2,1-2H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
 8.69n/an/an/an/an/an/an/an/a



SignalGene Inc.

Curated by ChEMBL


Assay Description
In vitro displacement of 0.5 nM [3H]17-beta-estradiol from human Estrogen receptor alpha

J Med Chem 46: 1408-18 (2003)


Article DOI: 10.1021/jm020536q
BindingDB Entry DOI: 10.7270/Q20R9Q5J
More data for this
Ligand-Target Pair