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PubMed code 10479291

Compile data set for download or QSAR
Found 12 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 receptor


(Homo sapiens (Human))
BDBM50080526
PNG
(1,4,4-Trimethyl-1,2,3,4-tetrahydro-quinoline-6-car...)
Show SMILES CCOC(=O)c1ccc(OC(=O)c2ccc3N(C)CCC(C)(C)c3c2)cc1
Show InChI InChI=1S/C22H25NO4/c1-5-26-20(24)15-6-9-17(10-7-15)27-21(25)16-8-11-19-18(14-16)22(2,3)12-13-23(19)4/h6-11,14H,5,12-13H2,1-4H3
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PubMed
n/an/an/an/a 256n/an/an/an/a



University of Oklahoma Health Sciences Center

Curated by ChEMBL


Assay Description
Transcriptional activation in CV-1 cells expressing Retinoic acid receptor RAR beta


J Med Chem 42: 3602-14 (1999)


Article DOI: 10.1021/jm9900974
BindingDB Entry DOI: 10.7270/Q2J38RRM
More data for this
Ligand-Target Pair
Retinoid X receptor gamma/retinoic acid receptor alpha


(Homo sapiens (Human))
BDBM50080526
PNG
(1,4,4-Trimethyl-1,2,3,4-tetrahydro-quinoline-6-car...)
Show SMILES CCOC(=O)c1ccc(OC(=O)c2ccc3N(C)CCC(C)(C)c3c2)cc1
Show InChI InChI=1S/C22H25NO4/c1-5-26-20(24)15-6-9-17(10-7-15)27-21(25)16-8-11-19-18(14-16)22(2,3)12-13-23(19)4/h6-11,14H,5,12-13H2,1-4H3
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n/an/an/an/a 1.13E+3n/an/an/an/a



University of Oklahoma Health Sciences Center

Curated by ChEMBL


Assay Description
Transcriptional activation in CV-1 cells expressing human Retinoic acid receptor alpha


J Med Chem 42: 3602-14 (1999)


Article DOI: 10.1021/jm9900974
BindingDB Entry DOI: 10.7270/Q2J38RRM
More data for this
Ligand-Target Pair
Retinoid X receptor beta


(Mus musculus)
BDBM50080524
PNG
(1-Isopropyl-4,4-dimethyl-1,2,3,4-tetrahydro-quinol...)
Show SMILES CCOC(=O)c1ccc(OC(=O)c2ccc3N(CCC(C)(C)c3c2)C(C)C)cc1
Show InChI InChI=1S/C24H29NO4/c1-6-28-22(26)17-7-10-19(11-8-17)29-23(27)18-9-12-21-20(15-18)24(4,5)13-14-25(21)16(2)3/h7-12,15-16H,6,13-14H2,1-5H3
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n/an/an/an/a 47n/an/an/an/a



University of Oklahoma Health Sciences Center

Curated by ChEMBL


Assay Description
Transcriptional activation in CV-1 cells expressing Retinoid X receptor RXR beta


J Med Chem 42: 3602-14 (1999)


Article DOI: 10.1021/jm9900974
BindingDB Entry DOI: 10.7270/Q2J38RRM
More data for this
Ligand-Target Pair
Retinoid X receptor gamma


(Mus musculus)
BDBM50080526
PNG
(1,4,4-Trimethyl-1,2,3,4-tetrahydro-quinoline-6-car...)
Show SMILES CCOC(=O)c1ccc(OC(=O)c2ccc3N(C)CCC(C)(C)c3c2)cc1
Show InChI InChI=1S/C22H25NO4/c1-5-26-20(24)15-6-9-17(10-7-15)27-21(25)16-8-11-19-18(14-16)22(2,3)12-13-23(19)4/h6-11,14H,5,12-13H2,1-4H3
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n/an/an/an/a 20n/an/an/an/a



University of Oklahoma Health Sciences Center

Curated by ChEMBL


Assay Description
Transcriptional activation in CV-1 cells expressing Retinoid X receptor RXR gamma


J Med Chem 42: 3602-14 (1999)


Article DOI: 10.1021/jm9900974
BindingDB Entry DOI: 10.7270/Q2J38RRM
More data for this
Ligand-Target Pair
Retinoid X receptor gamma/retinoic acid receptor alpha


(Homo sapiens (Human))
BDBM50080525
PNG
(1,4,4,7-Tetramethyl-1,2,3,4-tetrahydro-quinoline-6...)
Show SMILES CCOC(=O)c1ccc(OC(=O)c2cc3c(cc2C)N(C)CCC3(C)C)cc1
Show InChI InChI=1S/C23H27NO4/c1-6-27-21(25)16-7-9-17(10-8-16)28-22(26)18-14-19-20(13-15(18)2)24(5)12-11-23(19,3)4/h7-10,13-14H,6,11-12H2,1-5H3
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n/an/an/an/a 796n/an/an/an/a



University of Oklahoma Health Sciences Center

Curated by ChEMBL


Assay Description
Transcriptional activation in CV-1 cells expressing human Retinoic acid receptor alpha


J Med Chem 42: 3602-14 (1999)


Article DOI: 10.1021/jm9900974
BindingDB Entry DOI: 10.7270/Q2J38RRM
More data for this
Ligand-Target Pair
Retinoid receptor


(Homo sapiens (Human))
BDBM50080524
PNG
(1-Isopropyl-4,4-dimethyl-1,2,3,4-tetrahydro-quinol...)
Show SMILES CCOC(=O)c1ccc(OC(=O)c2ccc3N(CCC(C)(C)c3c2)C(C)C)cc1
Show InChI InChI=1S/C24H29NO4/c1-6-28-22(26)17-7-10-19(11-8-17)29-23(27)18-9-12-21-20(15-18)24(4,5)13-14-25(21)16(2)3/h7-12,15-16H,6,13-14H2,1-5H3
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n/an/an/an/a 41n/an/an/an/a



University of Oklahoma Health Sciences Center

Curated by ChEMBL


Assay Description
Transcriptional activation in CV-1 cells expressing Retinoic acid receptor RAR beta


J Med Chem 42: 3602-14 (1999)


Article DOI: 10.1021/jm9900974
BindingDB Entry DOI: 10.7270/Q2J38RRM
More data for this
Ligand-Target Pair
Retinoid X receptor gamma


(Mus musculus)
BDBM50080524
PNG
(1-Isopropyl-4,4-dimethyl-1,2,3,4-tetrahydro-quinol...)
Show SMILES CCOC(=O)c1ccc(OC(=O)c2ccc3N(CCC(C)(C)c3c2)C(C)C)cc1
Show InChI InChI=1S/C24H29NO4/c1-6-28-22(26)17-7-10-19(11-8-17)29-23(27)18-9-12-21-20(15-18)24(4,5)13-14-25(21)16(2)3/h7-12,15-16H,6,13-14H2,1-5H3
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n/an/an/an/a 27n/an/an/an/a



University of Oklahoma Health Sciences Center

Curated by ChEMBL


Assay Description
Transcriptional activation in CV-1 cells expressing Retinoid X receptor RXR gamma


J Med Chem 42: 3602-14 (1999)


Article DOI: 10.1021/jm9900974
BindingDB Entry DOI: 10.7270/Q2J38RRM
More data for this
Ligand-Target Pair
Retinoid receptor


(Homo sapiens (Human))
BDBM50080525
PNG
(1,4,4,7-Tetramethyl-1,2,3,4-tetrahydro-quinoline-6...)
Show SMILES CCOC(=O)c1ccc(OC(=O)c2cc3c(cc2C)N(C)CCC3(C)C)cc1
Show InChI InChI=1S/C23H27NO4/c1-6-27-21(25)16-7-9-17(10-8-16)28-22(26)18-14-19-20(13-15(18)2)24(5)12-11-23(19,3)4/h7-10,13-14H,6,11-12H2,1-5H3
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n/an/an/an/a 92n/an/an/an/a



University of Oklahoma Health Sciences Center

Curated by ChEMBL


Assay Description
Transcriptional activation in CV-1 cells expressing Retinoic acid receptor RAR beta


J Med Chem 42: 3602-14 (1999)


Article DOI: 10.1021/jm9900974
BindingDB Entry DOI: 10.7270/Q2J38RRM
More data for this
Ligand-Target Pair
Retinoid X receptor gamma/retinoic acid receptor alpha


(Homo sapiens (Human))
BDBM50080524
PNG
(1-Isopropyl-4,4-dimethyl-1,2,3,4-tetrahydro-quinol...)
Show SMILES CCOC(=O)c1ccc(OC(=O)c2ccc3N(CCC(C)(C)c3c2)C(C)C)cc1
Show InChI InChI=1S/C24H29NO4/c1-6-28-22(26)17-7-10-19(11-8-17)29-23(27)18-9-12-21-20(15-18)24(4,5)13-14-25(21)16(2)3/h7-12,15-16H,6,13-14H2,1-5H3
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PubMed
n/an/an/an/a 217n/an/an/an/a



University of Oklahoma Health Sciences Center

Curated by ChEMBL


Assay Description
Transcriptional activation in CV-1 cells expressing human Retinoic acid receptor alpha


J Med Chem 42: 3602-14 (1999)


Article DOI: 10.1021/jm9900974
BindingDB Entry DOI: 10.7270/Q2J38RRM
More data for this
Ligand-Target Pair
Retinoid X receptor beta


(Mus musculus)
BDBM50080526
PNG
(1,4,4-Trimethyl-1,2,3,4-tetrahydro-quinoline-6-car...)
Show SMILES CCOC(=O)c1ccc(OC(=O)c2ccc3N(C)CCC(C)(C)c3c2)cc1
Show InChI InChI=1S/C22H25NO4/c1-5-26-20(24)15-6-9-17(10-7-15)27-21(25)16-8-11-19-18(14-16)22(2,3)12-13-23(19)4/h6-11,14H,5,12-13H2,1-4H3
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n/an/an/an/a 33n/an/an/an/a



University of Oklahoma Health Sciences Center

Curated by ChEMBL


Assay Description
Transcriptional activation in CV-1 cells expressing Retinoid X receptor RXR beta


J Med Chem 42: 3602-14 (1999)


Article DOI: 10.1021/jm9900974
BindingDB Entry DOI: 10.7270/Q2J38RRM
More data for this
Ligand-Target Pair
Retinoid X receptor gamma


(Mus musculus)
BDBM50080525
PNG
(1,4,4,7-Tetramethyl-1,2,3,4-tetrahydro-quinoline-6...)
Show SMILES CCOC(=O)c1ccc(OC(=O)c2cc3c(cc2C)N(C)CCC3(C)C)cc1
Show InChI InChI=1S/C23H27NO4/c1-6-27-21(25)16-7-9-17(10-8-16)28-22(26)18-14-19-20(13-15(18)2)24(5)12-11-23(19,3)4/h7-10,13-14H,6,11-12H2,1-5H3
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n/an/an/an/a 49n/an/an/an/a



University of Oklahoma Health Sciences Center

Curated by ChEMBL


Assay Description
Transcriptional activation in CV-1 cells expressing Retinoid X receptor RXR gamma


J Med Chem 42: 3602-14 (1999)


Article DOI: 10.1021/jm9900974
BindingDB Entry DOI: 10.7270/Q2J38RRM
More data for this
Ligand-Target Pair
Retinoid X receptor beta


(Mus musculus)
BDBM50080525
PNG
(1,4,4,7-Tetramethyl-1,2,3,4-tetrahydro-quinoline-6...)
Show SMILES CCOC(=O)c1ccc(OC(=O)c2cc3c(cc2C)N(C)CCC3(C)C)cc1
Show InChI InChI=1S/C23H27NO4/c1-6-27-21(25)16-7-9-17(10-8-16)28-22(26)18-14-19-20(13-15(18)2)24(5)12-11-23(19,3)4/h7-10,13-14H,6,11-12H2,1-5H3
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n/an/an/an/a 70n/an/an/an/a



University of Oklahoma Health Sciences Center

Curated by ChEMBL


Assay Description
Transcriptional activation in CV-1 cells expressing Retinoid X receptor RXR beta


J Med Chem 42: 3602-14 (1999)


Article DOI: 10.1021/jm9900974
BindingDB Entry DOI: 10.7270/Q2J38RRM
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%