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BDBM50100957 (3E,5E,7E,9E)-1-(4-Hydroxy-phenyl)-4,8-dimethyl-10-(2,6,6-trimethyl-cyclohex-1-enyl)-deca-3,5,7,9-tetraen-2-one::CHEMBL290478

SMILES: C\C(\C=C\C1=C(C)CCCC1(C)C)=C/C=CC(C)=CC(=O)Cc1ccc(O)cc1

InChI Key: InChIKey=WKZPWMRGEOWZTC-GYDWKTBCSA-N

Data: 1 KI

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50100957   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Retinoid receptor


(Homo sapiens (Human))
BDBM50100957
PNG
((3E,5E,7E,9E)-1-(4-Hydroxy-phenyl)-4,8-dimethyl-10...)
Show SMILES C\C(\C=C\C1=C(C)CCCC1(C)C)=C/C=CC(C)=CC(=O)Cc1ccc(O)cc1 |w:18.19,15.16,c:4|
Show InChI InChI=1S/C27H34O2/c1-20(11-16-26-22(3)10-7-17-27(26,4)5)8-6-9-21(2)18-25(29)19-23-12-14-24(28)15-13-23/h6,8-9,11-16,18,28H,7,10,17,19H2,1-5H3/b9-6?,16-11+,20-8+,21-18?
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MMDB

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PubMed
>4.00E+3n/an/an/an/an/an/an/an/a



The Ohio State University

Curated by ChEMBL


Assay Description
Binding affinity against Retinoic acid receptor gamma


Bioorg Med Chem Lett 11: 1583-6 (2001)


BindingDB Entry DOI: 10.7270/Q20R9NQW
More data for this
Ligand-Target Pair