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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Estrogen receptor beta' and Ligand = 'BDBM50161593'   
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 beta


(Homo sapiens (Human))		BDBM50161593
PNG
(2-Fluoro-4-((1R,2R,5R)-5-hydroxymethyl-8-methyl-3-...)
Show SMILES CC1=CC[C@@]2(CO)CO[C@H]([C@@H]1C2)c1ccc(O)c(F)c1 |t:1|
Show InChI InChI=1S/C16H19FO3/c1-10-4-5-16(8-18)7-12(10)15(20-9-16)11-2-3-14(19)13(17)6-11/h2-4,6,12,15,18-19H,5,7-9H2,1H3/t12?,15-,16+/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
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PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/an/an/a 57n/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
In vitro agonist activity for estrogen receptor beta expressed in COS-1 cells

Bioorg Med Chem Lett 15: 1463-6 (2005)


Article DOI: 10.1016/j.bmcl.2004.12.077
BindingDB Entry DOI: 10.7270/Q25H7FR7
More data for this
Ligand-Target Pair