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PubMed code 19482478

Compile data set for download or QSAR
Found 5 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/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Retinoic acid receptor beta


(Mus musculus)
BDBM50346144
PNG
(4-[(1E)-3-(7,8-Dihydro-8,8-dimethyl-5-p-tolylnapht...)
Show SMILES Cc1ccc(cc1)C1=CCC(C)(C)c2cc(ccc12)C(=O)\C=C\c1ccc(cc1)C(O)=O |t:8|
Show InChI InChI=1S/C29H26O3/c1-19-4-9-21(10-5-19)24-16-17-29(2,3)26-18-23(13-14-25(24)26)27(30)15-8-20-6-11-22(12-7-20)28(31)32/h4-16,18H,17H2,1-3H3,(H,31,32)/b15-8+
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Article
PubMed
n/an/a 400n/an/an/an/an/an/a



Universidade de Vigo

Curated by ChEMBL


Assay Description
Antagonist activity at yeast GAL4 fused mouse RARbeta ligand binding domain expressed in HeLa cells assessed as inhibition of TTNPB-induced receptor ...


Bioorg Med Chem 17: 4345-59 (2009)


Article DOI: 10.1016/j.bmc.2009.05.035
BindingDB Entry DOI: 10.7270/Q2P26ZF6
More data for this
Ligand-Target Pair
Retinoic acid receptor alpha


(Mus musculus)
BDBM50346143
PNG
(CHEMBL1783648 | rac-4-[(1E)-3-(7,8-Dihydro-8,8-dim...)
Show SMILES Cc1ccc(cc1)C1=CCC(C)(C)c2cc(ccc12)C(O)\C=C\c1ccc(cc1)C(O)=O |t:8|
Show InChI InChI=1S/C29H28O3/c1-19-4-9-21(10-5-19)24-16-17-29(2,3)26-18-23(13-14-25(24)26)27(30)15-8-20-6-11-22(12-7-20)28(31)32/h4-16,18,27,30H,17H2,1-3H3,(H,31,32)/b15-8+
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PubMed
n/an/a 400n/an/an/an/an/an/a



Universidade de Vigo

Curated by ChEMBL


Assay Description
Antagonist activity at yeast GAL4 fused mouse RARalpha ligand binding domain expressed in HeLa cells assessed as inhibition of TTNPB-induced receptor...


Bioorg Med Chem 17: 4345-59 (2009)


Article DOI: 10.1016/j.bmc.2009.05.035
BindingDB Entry DOI: 10.7270/Q2P26ZF6
More data for this
Ligand-Target Pair
Retinoic acid receptor beta


(Mus musculus)
BDBM50346143
PNG
(CHEMBL1783648 | rac-4-[(1E)-3-(7,8-Dihydro-8,8-dim...)
Show SMILES Cc1ccc(cc1)C1=CCC(C)(C)c2cc(ccc12)C(O)\C=C\c1ccc(cc1)C(O)=O |t:8|
Show InChI InChI=1S/C29H28O3/c1-19-4-9-21(10-5-19)24-16-17-29(2,3)26-18-23(13-14-25(24)26)27(30)15-8-20-6-11-22(12-7-20)28(31)32/h4-16,18,27,30H,17H2,1-3H3,(H,31,32)/b15-8+
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PubMed
n/an/a 2.00E+3n/an/an/an/an/an/a



Universidade de Vigo

Curated by ChEMBL


Assay Description
Antagonist activity at yeast GAL4 fused mouse RARbeta ligand binding domain expressed in HeLa cells assessed as inhibition of TTNPB-induced receptor ...


Bioorg Med Chem 17: 4345-59 (2009)


Article DOI: 10.1016/j.bmc.2009.05.035
BindingDB Entry DOI: 10.7270/Q2P26ZF6
More data for this
Ligand-Target Pair
Retinoic acid receptor gamma


(Mus musculus)
BDBM50346146
PNG
(CHEMBL1783651 | rac-4-[3-(8,8-Dimethyl-5-(phenylet...)
Show SMILES CC1(C)CC=C(C#Cc2ccccc2)c2ccc(cc12)C1=NOC(C1)c1ccc(cc1)C(O)=O |t:4,23|
Show InChI InChI=1S/C30H25NO3/c1-30(2)17-16-21(9-8-20-6-4-3-5-7-20)25-15-14-24(18-26(25)30)27-19-28(34-31-27)22-10-12-23(13-11-22)29(32)33/h3-7,10-16,18,28H,17,19H2,1-2H3,(H,32,33)
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n/an/a 3.00E+3n/an/an/an/an/an/a



Universidade de Vigo

Curated by ChEMBL


Assay Description
Antagonist activity at yeast GAL4 fused mouse RARgamma ligand binding domain expressed in HeLa cells assessed as inhibition of TTNPB-induced receptor...


Bioorg Med Chem 17: 4345-59 (2009)


Article DOI: 10.1016/j.bmc.2009.05.035
BindingDB Entry DOI: 10.7270/Q2P26ZF6
More data for this
Ligand-Target Pair
Retinoic acid receptor gamma


(Mus musculus)
BDBM50346145
PNG
(CHEMBL1783649 | rac-4-[(3-(8,8-Dimethyl-5-phenyl-7...)
Show SMILES CC1(C)CC=C(c2ccccc2)c2ccc(cc12)C1=NOC(C1)c1ccc(cc1)C(O)=O |t:4,21|
Show InChI InChI=1S/C28H25NO3/c1-28(2)15-14-22(18-6-4-3-5-7-18)23-13-12-21(16-24(23)28)25-17-26(32-29-25)19-8-10-20(11-9-19)27(30)31/h3-14,16,26H,15,17H2,1-2H3,(H,30,31)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Universidade de Vigo

Curated by ChEMBL


Assay Description
Antagonist activity at yeast GAL4 fused mouse RARgamma ligand binding domain expressed in HeLa cells assessed as inhibition of TTNPB-induced receptor...


Bioorg Med Chem 17: 4345-59 (2009)


Article DOI: 10.1016/j.bmc.2009.05.035
BindingDB Entry DOI: 10.7270/Q2P26ZF6
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%