BindingDB logo
myBDB logout

PubMed code 25838141

Compile data set for download or QSAR
Found 8 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Retinoid X receptor gamma/retinoic acid receptor alpha


(Homo sapiens (Human))
BDBM53426
PNG
(Acylated oxime isatin derivative, 15 | MLS00069763...)
Show SMILES CC1Oc2cc3oc4c(O)c5OC(C)(C)C=Cc5cc4c(=O)c3c(O)c2C1(C)C
Show InChI InChI=1S/C23H22O6/c1-10-23(4,5)16-14(27-10)9-13-15(18(16)25)17(24)12-8-11-6-7-22(2,3)29-20(11)19(26)21(12)28-13/h6-10,25-26H,1-5H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 170n/an/an/an/a



Aichi Gakuin University

Curated by ChEMBL


Assay Description
Agonist activity at RARalpha (unknown origin) expressed in HEK293 cells assessed as transcriptional activation after 48 hrs by luciferase reporter ge...


Bioorg Med Chem Lett 25: 1998-2001 (2015)


Article DOI: 10.1016/j.bmcl.2015.02.075
BindingDB Entry DOI: 10.7270/Q2KK9DGD
More data for this
Ligand-Target Pair
Retinoid X receptor gamma/retinoic acid receptor alpha


(Homo sapiens (Human))
BDBM50067591
PNG
(CHEMBL3400678)
Show SMILES CC(C)=CCc1c(O)ccc2oc3c4C=CC(C)(C)Oc4cc(O)c3c(=O)c12
Show InChI InChI=1S/C23H22O5/c1-12(2)5-6-13-15(24)7-8-17-19(13)21(26)20-16(25)11-18-14(22(20)27-17)9-10-23(3,4)28-18/h5,7-11,24-25H,6H2,1-4H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 110n/an/an/an/a



Aichi Gakuin University

Curated by ChEMBL


Assay Description
Agonist activity at RARalpha (unknown origin) expressed in HEK293 cells assessed as transcriptional activation after 48 hrs by luciferase reporter ge...


Bioorg Med Chem Lett 25: 1998-2001 (2015)


Article DOI: 10.1016/j.bmcl.2015.02.075
BindingDB Entry DOI: 10.7270/Q2KK9DGD
More data for this
Ligand-Target Pair
Retinoid X receptor gamma/retinoic acid receptor alpha


(Homo sapiens (Human))
BDBM50067588
PNG
(CHEMBL3400677)
Show SMILES CC(C)(O)C1Cc2c(O1)ccc1oc3c4C=CC(C)(C)Oc4cc(O)c3c(=O)c21
Show InChI InChI=1S/C23H22O6/c1-22(2)8-7-11-16(29-22)10-13(24)19-20(25)18-12-9-17(23(3,4)26)27-14(12)5-6-15(18)28-21(11)19/h5-8,10,17,24,26H,9H2,1-4H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 170n/an/an/an/a



Aichi Gakuin University

Curated by ChEMBL


Assay Description
Agonist activity at RARalpha (unknown origin) expressed in HEK293 cells assessed as transcriptional activation after 48 hrs by luciferase reporter ge...


Bioorg Med Chem Lett 25: 1998-2001 (2015)


Article DOI: 10.1016/j.bmcl.2015.02.075
BindingDB Entry DOI: 10.7270/Q2KK9DGD
More data for this
Ligand-Target Pair
Retinoid X receptor gamma/retinoic acid receptor alpha


(Homo sapiens (Human))
BDBM50067591
PNG
(CHEMBL3400678)
Show SMILES CC(C)=CCc1c(O)ccc2oc3c4C=CC(C)(C)Oc4cc(O)c3c(=O)c12
Show InChI InChI=1S/C23H22O5/c1-12(2)5-6-13-15(24)7-8-17-19(13)21(26)20-16(25)11-18-14(22(20)27-17)9-10-23(3,4)28-18/h5,7-11,24-25H,6H2,1-4H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 200n/an/an/an/a



Aichi Gakuin University

Curated by ChEMBL


Assay Description
Agonist activity at RARalpha (unknown origin) expressed in HEK293 cells assessed as transcriptional activation after 48 hrs by luciferase reporter ge...


Bioorg Med Chem Lett 25: 1998-2001 (2015)


Article DOI: 10.1016/j.bmcl.2015.02.075
BindingDB Entry DOI: 10.7270/Q2KK9DGD
More data for this
Ligand-Target Pair
Retinoid X receptor gamma/retinoic acid receptor alpha


(Homo sapiens (Human))
BDBM50067588
PNG
(CHEMBL3400677)
Show SMILES CC(C)(O)C1Cc2c(O1)ccc1oc3c4C=CC(C)(C)Oc4cc(O)c3c(=O)c21
Show InChI InChI=1S/C23H22O6/c1-22(2)8-7-11-16(29-22)10-13(24)19-20(25)18-12-9-17(23(3,4)26)27-14(12)5-6-15(18)28-21(11)19/h5-8,10,17,24,26H,9H2,1-4H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 65n/an/an/an/a



Aichi Gakuin University

Curated by ChEMBL


Assay Description
Agonist activity at RARalpha (unknown origin) expressed in HEK293 cells assessed as transcriptional activation after 48 hrs by luciferase reporter ge...


Bioorg Med Chem Lett 25: 1998-2001 (2015)


Article DOI: 10.1016/j.bmcl.2015.02.075
BindingDB Entry DOI: 10.7270/Q2KK9DGD
More data for this
Ligand-Target Pair
Retinoid X receptor gamma/retinoic acid receptor alpha


(Homo sapiens (Human))
BDBM53426
PNG
(Acylated oxime isatin derivative, 15 | MLS00069763...)
Show SMILES CC1Oc2cc3oc4c(O)c5OC(C)(C)C=Cc5cc4c(=O)c3c(O)c2C1(C)C
Show InChI InChI=1S/C23H22O6/c1-10-23(4,5)16-14(27-10)9-13-15(18(16)25)17(24)12-8-11-6-7-22(2,3)29-20(11)19(26)21(12)28-13/h6-10,25-26H,1-5H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 200n/an/an/an/a



Aichi Gakuin University

Curated by ChEMBL


Assay Description
Agonist activity at RARalpha (unknown origin) expressed in HEK293 cells assessed as transcriptional activation after 48 hrs by luciferase reporter ge...


Bioorg Med Chem Lett 25: 1998-2001 (2015)


Article DOI: 10.1016/j.bmcl.2015.02.075
BindingDB Entry DOI: 10.7270/Q2KK9DGD
More data for this
Ligand-Target Pair
Retinoid X receptor gamma/retinoic acid receptor alpha


(Homo sapiens (Human))
BDBM50067590
PNG
(GERONTOXANTHONE B)
Show SMILES CC(C)(C=C)c1c(O)cc2oc3c(O)c4OC(C)(C)C=Cc4cc3c(=O)c2c1O
Show InChI InChI=1S/C23H22O6/c1-6-22(2,3)16-13(24)10-14-15(18(16)26)17(25)12-9-11-7-8-23(4,5)29-20(11)19(27)21(12)28-14/h6-10,24,26-27H,1H2,2-5H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 1.70E+3n/an/an/an/a



Aichi Gakuin University

Curated by ChEMBL


Assay Description
Agonist activity at RARalpha (unknown origin) expressed in HEK293 cells assessed as transcriptional activation after 48 hrs by luciferase reporter ge...


Bioorg Med Chem Lett 25: 1998-2001 (2015)


Article DOI: 10.1016/j.bmcl.2015.02.075
BindingDB Entry DOI: 10.7270/Q2KK9DGD
More data for this
Ligand-Target Pair
Retinoid X receptor gamma/retinoic acid receptor alpha


(Homo sapiens (Human))
BDBM50067590
PNG
(GERONTOXANTHONE B)
Show SMILES CC(C)(C=C)c1c(O)cc2oc3c(O)c4OC(C)(C)C=Cc4cc3c(=O)c2c1O
Show InChI InChI=1S/C23H22O6/c1-6-22(2,3)16-13(24)10-14-15(18(16)26)17(25)12-9-11-7-8-23(4,5)29-20(11)19(27)21(12)28-14/h6-10,24,26-27H,1H2,2-5H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 2.00E+3n/an/an/an/a



Aichi Gakuin University

Curated by ChEMBL


Assay Description
Agonist activity at RARalpha (unknown origin) expressed in HEK293 cells assessed as transcriptional activation after 48 hrs by luciferase reporter ge...


Bioorg Med Chem Lett 25: 1998-2001 (2015)


Article DOI: 10.1016/j.bmcl.2015.02.075
BindingDB Entry DOI: 10.7270/Q2KK9DGD
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%