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SMILES: C\C(CCC1=C(C)CCCC1(C)C)=C/c1ccc(cc1)C(O)=O

InChI Key: InChIKey=BTFYSNDGWSYEGA-CCEZHUSRSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50045272   
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
Retinoic acid receptor beta


(Homo sapiens (Human))
BDBM50045272
PNG
(4-[2-Methyl-4-(2,6,6-trimethyl-cyclohex-1-enyl)-bu...)
Show SMILES C\C(CCC1=C(C)CCCC1(C)C)=C/c1ccc(cc1)C(O)=O |c:4|
Show InChI InChI=1S/C21H28O2/c1-15(14-17-8-10-18(11-9-17)20(22)23)7-12-19-16(2)6-5-13-21(19,3)4/h8-11,14H,5-7,12-13H2,1-4H3,(H,22,23)/b15-14+
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PubMed
n/an/an/an/a 20n/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Effective concentration against Retinoic acid receptor beta


J Med Chem 36: 2605-13 (1993)


BindingDB Entry DOI: 10.7270/Q21R6PKP
More data for this
Ligand-Target Pair
Retinoic acid receptor alpha


(Homo sapiens (Human))
BDBM50045272
PNG
(4-[2-Methyl-4-(2,6,6-trimethyl-cyclohex-1-enyl)-bu...)
Show SMILES C\C(CCC1=C(C)CCCC1(C)C)=C/c1ccc(cc1)C(O)=O |c:4|
Show InChI InChI=1S/C21H28O2/c1-15(14-17-8-10-18(11-9-17)20(22)23)7-12-19-16(2)6-5-13-21(19,3)4/h8-11,14H,5-7,12-13H2,1-4H3,(H,22,23)/b15-14+
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n/an/an/an/a 550n/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Effective concentration against RAR-alpha receptor


J Med Chem 36: 2605-13 (1993)


BindingDB Entry DOI: 10.7270/Q21R6PKP
More data for this
Ligand-Target Pair
Retinoic acid receptor gamma


(Homo sapiens (Human))
BDBM50045272
PNG
(4-[2-Methyl-4-(2,6,6-trimethyl-cyclohex-1-enyl)-bu...)
Show SMILES C\C(CCC1=C(C)CCCC1(C)C)=C/c1ccc(cc1)C(O)=O |c:4|
Show InChI InChI=1S/C21H28O2/c1-15(14-17-8-10-18(11-9-17)20(22)23)7-12-19-16(2)6-5-13-21(19,3)4/h8-11,14H,5-7,12-13H2,1-4H3,(H,22,23)/b15-14+
PDB
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PubMed
n/an/an/an/a 210n/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Effective concentration against RAR-gamma receptor


J Med Chem 36: 2605-13 (1993)


BindingDB Entry DOI: 10.7270/Q21R6PKP
More data for this
Ligand-Target Pair
Retinoic acid receptor RXR-alpha


(Homo sapiens (Human))
BDBM50045272
PNG
(4-[2-Methyl-4-(2,6,6-trimethyl-cyclohex-1-enyl)-bu...)
Show SMILES C\C(CCC1=C(C)CCCC1(C)C)=C/c1ccc(cc1)C(O)=O |c:4|
Show InChI InChI=1S/C21H28O2/c1-15(14-17-8-10-18(11-9-17)20(22)23)7-12-19-16(2)6-5-13-21(19,3)4/h8-11,14H,5-7,12-13H2,1-4H3,(H,22,23)/b15-14+
PDB
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NCI pathway
Reactome pathway
KEGG

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PubMed
n/an/an/an/a 1.50E+3n/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Effective concentration against RXR-alpha receptor


J Med Chem 36: 2605-13 (1993)


BindingDB Entry DOI: 10.7270/Q21R6PKP
More data for this
Ligand-Target Pair