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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 50427835   
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
Steroid hormone receptor ERR1


(Homo sapiens (Human))
BDBM50427835
PNG
(CHEMBL2326069)
Show SMILES CCOC(=O)C(Cc1ccc(cc1)C#CCCCC[C@@H]1Cc2cc(O)ccc2[C@H]2CC[C@]3(C)[C@@H](O)CC[C@H]3[C@H]12)C(=O)OCC |r|
Show InChI InChI=1S/C38H48O6/c1-4-43-36(41)32(37(42)44-5-2)22-26-14-12-25(13-15-26)10-8-6-7-9-11-27-23-28-24-29(39)16-17-30(28)31-20-21-38(3)33(35(27)31)18-19-34(38)40/h12-17,24,27,31-35,39-40H,4-7,9,11,18-23H2,1-3H3/t27-,31-,33+,34+,35-,38+/m1/s1
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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 126n/an/an/an/an/an/a



University of Kansas Medical Center

Curated by ChEMBL


Assay Description
Displacement of [3H]E2 from human recombinant ERalpha receptor after overnight incubation by liquid scintillation counting analysis


J Med Chem 56: 2779-90 (2013)


Article DOI: 10.1021/jm3013773
BindingDB Entry DOI: 10.7270/Q2CC121G
More data for this
Ligand-Target Pair
Isoform 1 of Steroid hormone receptor ERR2 (ERRbeta2-delta10)


(Homo sapiens (Human))
BDBM50427835
PNG
(CHEMBL2326069)
Show SMILES CCOC(=O)C(Cc1ccc(cc1)C#CCCCC[C@@H]1Cc2cc(O)ccc2[C@H]2CC[C@]3(C)[C@@H](O)CC[C@H]3[C@H]12)C(=O)OCC |r|
Show InChI InChI=1S/C38H48O6/c1-4-43-36(41)32(37(42)44-5-2)22-26-14-12-25(13-15-26)10-8-6-7-9-11-27-23-28-24-29(39)16-17-30(28)31-20-21-38(3)33(35(27)31)18-19-34(38)40/h12-17,24,27,31-35,39-40H,4-7,9,11,18-23H2,1-3H3/t27-,31-,33+,34+,35-,38+/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 151n/an/an/an/an/an/a



University of Kansas Medical Center

Curated by ChEMBL


Assay Description
Displacement of [3H]E2 from human recombinant ERbeta receptor after overnight incubation by liquid scintillation counting analysis


J Med Chem 56: 2779-90 (2013)


Article DOI: 10.1021/jm3013773
BindingDB Entry DOI: 10.7270/Q2CC121G
More data for this
Ligand-Target Pair