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Compile Data Set for Download or QSAR

Found 86 hits Enz. Inhib. hit(s) with Target = 'Nuclear receptor subfamily 1 group D member 1'   
Target
(Institution)
LigandTarget
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
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50366239
PNG
(CHEMBL1961797)
Show SMILES CCCCCNC(=O)N1CCC(CN(Cc2ccc(s2)[N+]([O-])=O)Cc2ccc(Cl)cc2)C1
Show InChI InChI=1S/C23H31ClN4O3S/c1-2-3-4-12-25-23(29)27-13-11-19(16-27)15-26(14-18-5-7-20(24)8-6-18)17-21-9-10-22(32-21)28(30)31/h5-10,19H,2-4,11-17H2,1H3,(H,25,29)
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n/an/a 620n/an/an/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
REV-ERB-alpha mediated transcriptional suppression at Bmal1 promoter in HEK293 cell reporter assay


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50366238
PNG
(CHEMBL1961796)
Show SMILES CCOC(=O)N1CCC(CN(Cc2ccc(s2)[N+]([O-])=O)Cc2ccc(Cl)cc2)C1
Show InChI InChI=1S/C20H24ClN3O4S/c1-2-28-20(25)23-10-9-16(13-23)12-22(11-15-3-5-17(21)6-4-15)14-18-7-8-19(29-18)24(26)27/h3-8,16H,2,9-14H2,1H3
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n/an/a 670n/an/an/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Increased REV-ERB-alpha LBD dependent repressor activity in HEK293 cell reporter assay


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50366238
PNG
(CHEMBL1961796)
Show SMILES CCOC(=O)N1CCC(CN(Cc2ccc(s2)[N+]([O-])=O)Cc2ccc(Cl)cc2)C1
Show InChI InChI=1S/C20H24ClN3O4S/c1-2-28-20(25)23-10-9-16(13-23)12-22(11-15-3-5-17(21)6-4-15)14-18-7-8-19(29-18)24(26)27/h3-8,16H,2,9-14H2,1H3
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n/an/a 670n/an/an/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-Erbalpha expressed in HEK293 cells coexpressing Gal4 ligand binding domain assessed as inhibition of transcription after 24 h...


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50366238
PNG
(CHEMBL1961796)
Show SMILES CCOC(=O)N1CCC(CN(Cc2ccc(s2)[N+]([O-])=O)Cc2ccc(Cl)cc2)C1
Show InChI InChI=1S/C20H24ClN3O4S/c1-2-28-20(25)23-10-9-16(13-23)12-22(11-15-3-5-17(21)6-4-15)14-18-7-8-19(29-18)24(26)27/h3-8,16H,2,9-14H2,1H3
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n/an/a 710n/an/an/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
REV-ERB-alpha mediated transcriptional suppression at Bmal1 promoter in HEK293 cell reporter assay


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50366239
PNG
(CHEMBL1961797)
Show SMILES CCCCCNC(=O)N1CCC(CN(Cc2ccc(s2)[N+]([O-])=O)Cc2ccc(Cl)cc2)C1
Show InChI InChI=1S/C23H31ClN4O3S/c1-2-3-4-12-25-23(29)27-13-11-19(16-27)15-26(14-18-5-7-20(24)8-6-18)17-21-9-10-22(32-21)28(30)31/h5-10,19H,2-4,11-17H2,1H3,(H,25,29)
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n/an/a 790n/an/an/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Increased REV-ERB-alpha LBD dependent repressor activity in HEK293 cell reporter assay


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50366238
PNG
(CHEMBL1961796)
Show SMILES CCOC(=O)N1CCC(CN(Cc2ccc(s2)[N+]([O-])=O)Cc2ccc(Cl)cc2)C1
Show InChI InChI=1S/C20H24ClN3O4S/c1-2-28-20(25)23-10-9-16(13-23)12-22(11-15-3-5-17(21)6-4-15)14-18-7-8-19(29-18)24(26)27/h3-8,16H,2,9-14H2,1H3
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n/an/an/a 800n/an/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Dissociation constant for binding to REV-ERB-alpha by circular dichroism


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50383684
PNG
(CHEMBL1961795)
Show SMILES CC(C)(C)OC(=O)CN(Cc1ccc(s1)[N+]([O-])=O)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C18H21ClN2O4S/c1-18(2,3)25-17(22)12-20(10-13-4-6-14(19)7-5-13)11-15-8-9-16(26-15)21(23)24/h4-9H,10-12H2,1-3H3
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n/an/an/an/a 2.30E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-Erbalpha expressed in HEK293 cells coexpressing BamII promoter assessed as repression of transcription after 24 hrs by dual-G...


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50388627
PNG
(CHEMBL2059543)
Show SMILES COc1ccc(CN(CC(=O)OC(C)(C)C)Cc2ccc(s2)[N+]([O-])=O)cc1
Show InChI InChI=1S/C19H24N2O5S/c1-19(2,3)26-18(22)13-20(11-14-5-7-15(25-4)8-6-14)12-16-9-10-17(27-16)21(23)24/h5-10H,11-13H2,1-4H3
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n/an/an/an/a 2.90E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-Erbalpha expressed in HEK293 cells coexpressing BamII promoter assessed as repression of transcription after 24 hrs by dual-G...


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50388628
PNG
(CHEMBL2059544)
Show SMILES CC(C)(C)OC(=O)CN(Cc1ccc(s1)[N+]([O-])=O)Cc1ccc(F)cc1
Show InChI InChI=1S/C18H21FN2O4S/c1-18(2,3)25-17(22)12-20(10-13-4-6-14(19)7-5-13)11-15-8-9-16(26-15)21(23)24/h4-9H,10-12H2,1-3H3
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n/an/an/an/a 2.00E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-Erbalpha expressed in HEK293 cells coexpressing BamII promoter assessed as repression of transcription after 24 hrs by dual-G...


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50388629
PNG
(CHEMBL2059545)
Show SMILES CC(C)(C)OC(=O)CN(Cc1ccc(s1)[N+]([O-])=O)Cc1cccc2ccccc12
Show InChI InChI=1S/C22H24N2O4S/c1-22(2,3)28-21(25)15-23(14-18-11-12-20(29-18)24(26)27)13-17-9-6-8-16-7-4-5-10-19(16)17/h4-12H,13-15H2,1-3H3
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n/an/an/an/a 2.50E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-Erbalpha expressed in HEK293 cells coexpressing BamII promoter assessed as repression of transcription after 24 hrs by dual-G...


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50388630
PNG
(CHEMBL2059547)
Show SMILES Cc1ccc(cc1)S(=O)(=O)N(CC(=O)OC(C)(C)C)Cc1ccc(s1)[N+]([O-])=O
Show InChI InChI=1S/C18H22N2O6S2/c1-13-5-8-15(9-6-13)28(24,25)19(12-17(21)26-18(2,3)4)11-14-7-10-16(27-14)20(22)23/h5-10H,11-12H2,1-4H3
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n/an/an/an/a 3.00E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-Erbalpha expressed in HEK293 cells coexpressing BamII promoter assessed as repression of transcription after 24 hrs by dual-G...


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50388631
PNG
(CHEMBL2059548)
Show SMILES CC(C)(C)OC(=O)CN(Cc1ccc(s1)[N+]([O-])=O)C(=O)c1cccc2ccccc12
Show InChI InChI=1S/C22H22N2O5S/c1-22(2,3)29-20(25)14-23(13-16-11-12-19(30-16)24(27)28)21(26)18-10-6-8-15-7-4-5-9-17(15)18/h4-12H,13-14H2,1-3H3
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n/an/an/an/a 2.60E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-Erbalpha expressed in HEK293 cells coexpressing BamII promoter assessed as repression of transcription after 24 hrs by dual-G...


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50388632
PNG
(CHEMBL2059549)
Show SMILES CC(C)(C)OC(=O)CN(Cc1ccc(s1)[N+]([O-])=O)S(=O)(=O)c1cccc2ccccc12
Show InChI InChI=1S/C21H22N2O6S2/c1-21(2,3)29-20(24)14-22(13-16-11-12-19(30-16)23(25)26)31(27,28)18-10-6-8-15-7-4-5-9-17(15)18/h4-12H,13-14H2,1-3H3
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n/an/an/an/a 800n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-Erbalpha expressed in HEK293 cells coexpressing BamII promoter assessed as repression of transcription after 24 hrs by dual-G...


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50388633
PNG
(CHEMBL2059550)
Show SMILES COC(=O)CN(Cc1ccc(s1)[N+]([O-])=O)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C15H15ClN2O4S/c1-22-15(19)10-17(8-11-2-4-12(16)5-3-11)9-13-6-7-14(23-13)18(20)21/h2-7H,8-10H2,1H3
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n/an/an/an/a 3.90E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-Erbalpha expressed in HEK293 cells coexpressing BamII promoter assessed as repression of transcription after 24 hrs by dual-G...


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50388634
PNG
(CHEMBL2059552)
Show SMILES NC(=O)CN(Cc1ccc(s1)[N+]([O-])=O)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C14H14ClN3O3S/c15-11-3-1-10(2-4-11)7-17(9-13(16)19)8-12-5-6-14(22-12)18(20)21/h1-6H,7-9H2,(H2,16,19)
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n/an/an/an/a 3.00E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-Erbalpha expressed in HEK293 cells coexpressing BamII promoter assessed as repression of transcription after 24 hrs by dual-G...


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50388635
PNG
(CHEMBL2059553)
Show SMILES [O-][N+](=O)c1ccc(CN(CC#N)Cc2ccc(Cl)cc2)s1
Show InChI InChI=1S/C14H12ClN3O2S/c15-12-3-1-11(2-4-12)9-17(8-7-16)10-13-5-6-14(21-13)18(19)20/h1-6H,8-10H2
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n/an/an/an/a 2.50E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-Erbalpha expressed in HEK293 cells coexpressing BamII promoter assessed as repression of transcription after 24 hrs by dual-G...


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50388636
PNG
(CHEMBL2059554)
Show SMILES [O-][N+](=O)c1ccc(CN(Cc2ccc(Cl)cc2)Cc2ccc3ccccc3c2)s1
Show InChI InChI=1S/C23H19ClN2O2S/c24-21-9-6-17(7-10-21)14-25(16-22-11-12-23(29-22)26(27)28)15-18-5-8-19-3-1-2-4-20(19)13-18/h1-13H,14-16H2
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n/an/an/an/a 8.80E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-Erbalpha expressed in HEK293 cells coexpressing BamII promoter assessed as repression of transcription after 24 hrs by dual-G...


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50388637
PNG
(CHEMBL2059555)
Show SMILES [O-][N+](=O)c1ccc(CN(Cc2ccc(Cl)cc2)Cc2ccc(cc2)C(F)(F)F)s1
Show InChI InChI=1S/C20H16ClF3N2O2S/c21-17-7-3-15(4-8-17)12-25(13-18-9-10-19(29-18)26(27)28)11-14-1-5-16(6-2-14)20(22,23)24/h1-10H,11-13H2
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n/an/an/an/a 5.50E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-Erbalpha expressed in HEK293 cells coexpressing BamII promoter assessed as repression of transcription after 24 hrs by dual-G...


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50388638
PNG
(CHEMBL2059556)
Show SMILES [O-][N+](=O)c1ccc(CN(Cc2nc3ccccc3s2)Cc2ccc(Cl)cc2)s1
Show InChI InChI=1S/C20H16ClN3O2S2/c21-15-7-5-14(6-8-15)11-23(12-16-9-10-20(27-16)24(25)26)13-19-22-17-3-1-2-4-18(17)28-19/h1-10H,11-13H2
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n/an/an/an/a 4.00E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-Erbalpha expressed in HEK293 cells coexpressing BamII promoter assessed as repression of transcription after 24 hrs by dual-G...


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50388639
PNG
(CHEMBL2059558)
Show SMILES [O-][N+](=O)c1ccc(CN(CC2COc3ccccc3O2)Cc2ccc(Cl)cc2)s1
Show InChI InChI=1S/C21H19ClN2O4S/c22-16-7-5-15(6-8-16)11-23(13-18-9-10-21(29-18)24(25)26)12-17-14-27-19-3-1-2-4-20(19)28-17/h1-10,17H,11-14H2
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n/an/an/an/a 7.80E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-Erbalpha expressed in HEK293 cells coexpressing BamII promoter assessed as repression of transcription after 24 hrs by dual-G...


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50388640
PNG
(CHEMBL2059559)
Show SMILES [O-][N+](=O)c1ccc(CN(CC2CCCCC2)Cc2ccc(Cl)cc2)s1
Show InChI InChI=1S/C19H23ClN2O2S/c20-17-8-6-16(7-9-17)13-21(12-15-4-2-1-3-5-15)14-18-10-11-19(25-18)22(23)24/h6-11,15H,1-5,12-14H2
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n/an/an/an/a 7.40E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-Erbalpha expressed in HEK293 cells coexpressing BamII promoter assessed as repression of transcription after 24 hrs by dual-G...


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50388641
PNG
(CHEMBL2059560)
Show SMILES CC(C)(C)OC(=O)N1CCC(CN(Cc2ccc(s2)[N+]([O-])=O)Cc2ccc(Cl)cc2)C1
Show InChI InChI=1S/C22H28ClN3O4S/c1-22(2,3)30-21(27)25-11-10-17(14-25)13-24(12-16-4-6-18(23)7-5-16)15-19-8-9-20(31-19)26(28)29/h4-9,17H,10-15H2,1-3H3
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n/an/an/an/a 1.80E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-Erbalpha expressed in HEK293 cells coexpressing BamII promoter assessed as repression of transcription after 24 hrs by dual-G...


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50388642
PNG
(CHEMBL2059561)
Show SMILES [O-][N+](=O)c1ccc(CN(Cc2ccc(Cl)cc2)C(=O)c2cccc3ccccc23)s1
Show InChI InChI=1S/C23H17ClN2O3S/c24-18-10-8-16(9-11-18)14-25(15-19-12-13-22(30-19)26(28)29)23(27)21-7-3-5-17-4-1-2-6-20(17)21/h1-13H,14-15H2
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n/an/an/an/a 2.60E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-Erbalpha expressed in HEK293 cells coexpressing BamII promoter assessed as repression of transcription after 24 hrs by dual-G...


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50388643
PNG
(CHEMBL2059562)
Show SMILES Cc1ccc(cc1)S(=O)(=O)N(Cc1ccc(s1)[N+]([O-])=O)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C19H17ClN2O4S2/c1-14-2-9-18(10-3-14)28(25,26)21(12-15-4-6-16(20)7-5-15)13-17-8-11-19(27-17)22(23)24/h2-11H,12-13H2,1H3
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n/an/an/an/a 2.50E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-Erbalpha expressed in HEK293 cells coexpressing BamII promoter assessed as repression of transcription after 24 hrs by dual-G...


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50388644
PNG
(CHEMBL2059567)
Show SMILES CC(C)(C)OC(=O)N1CCC(C1)N(Cc1ccc(s1)[N+]([O-])=O)Cc1ccc(Cl)cc1
Show InChI InChI=1S/C21H26ClN3O4S/c1-21(2,3)29-20(26)23-11-10-17(13-23)24(12-15-4-6-16(22)7-5-15)14-18-8-9-19(30-18)25(27)28/h4-9,17H,10-14H2,1-3H3
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n/an/an/an/a 1.60E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-Erbalpha expressed in HEK293 cells coexpressing BamII promoter assessed as repression of transcription after 24 hrs by dual-G...


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50366238
PNG
(CHEMBL1961796)
Show SMILES CCOC(=O)N1CCC(CN(Cc2ccc(s2)[N+]([O-])=O)Cc2ccc(Cl)cc2)C1
Show InChI InChI=1S/C20H24ClN3O4S/c1-2-28-20(25)23-10-9-16(13-23)12-22(11-15-3-5-17(21)6-4-15)14-18-7-8-19(29-18)24(26)27/h3-8,16H,2,9-14H2,1H3
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n/an/an/an/a 700n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-Erbalpha expressed in HEK293 cells coexpressing BamII promoter assessed as repression of transcription after 24 hrs by dual-G...


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50388645
PNG
(CHEMBL2059572)
Show SMILES [O-][N+](=O)c1ccc(CN(CC2CCN(C2)C(=O)OCC=C)Cc2ccc(Cl)cc2)s1
Show InChI InChI=1S/C21H24ClN3O4S/c1-2-11-29-21(26)24-10-9-17(14-24)13-23(12-16-3-5-18(22)6-4-16)15-19-7-8-20(30-19)25(27)28/h2-8,17H,1,9-15H2
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n/an/an/an/a 670n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-Erbalpha expressed in HEK293 cells coexpressing BamII promoter assessed as repression of transcription after 24 hrs by dual-G...


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50388646
PNG
(CHEMBL2059573)
Show SMILES [O-][N+](=O)c1ccc(CN(CC2CCN(C2)C(=O)Nc2ccccc2)Cc2ccc(Cl)cc2)s1
Show InChI InChI=1S/C24H25ClN4O3S/c25-20-8-6-18(7-9-20)14-27(17-22-10-11-23(33-22)29(31)32)15-19-12-13-28(16-19)24(30)26-21-4-2-1-3-5-21/h1-11,19H,12-17H2,(H,26,30)
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n/an/an/an/a 620n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-Erbalpha expressed in HEK293 cells coexpressing BamII promoter assessed as repression of transcription after 24 hrs by dual-G...


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50388647
PNG
(CHEMBL2059574)
Show SMILES CCCCNC(=O)N1CCC(CN(Cc2ccc(s2)[N+]([O-])=O)Cc2ccc(Cl)cc2)C1
Show InChI InChI=1S/C22H29ClN4O3S/c1-2-3-11-24-22(28)26-12-10-18(15-26)14-25(13-17-4-6-19(23)7-5-17)16-20-8-9-21(31-20)27(29)30/h4-9,18H,2-3,10-16H2,1H3,(H,24,28)
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n/an/an/an/a 670n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-Erbalpha expressed in HEK293 cells coexpressing BamII promoter assessed as repression of transcription after 24 hrs by dual-G...


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50388648
PNG
(CHEMBL2059696)
Show SMILES [O-][N+](=O)c1ccc(CN(CC2CCN(C2)C(=O)Nc2ccc(cc2)[N+]([O-])=O)Cc2ccc(Cl)cc2)s1
Show InChI InChI=1S/C24H24ClN5O5S/c25-19-3-1-17(2-4-19)13-27(16-22-9-10-23(36-22)30(34)35)14-18-11-12-28(15-18)24(31)26-20-5-7-21(8-6-20)29(32)33/h1-10,18H,11-16H2,(H,26,31)
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n/an/an/an/a 400n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-Erbalpha expressed in HEK293 cells coexpressing BamII promoter assessed as repression of transcription after 24 hrs by dual-G...


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50388649
PNG
(CHEMBL2059697)
Show SMILES CS(=O)(=O)N1CCC(CN(Cc2ccc(s2)[N+]([O-])=O)Cc2ccc(Cl)cc2)C1
Show InChI InChI=1S/C18H22ClN3O4S2/c1-28(25,26)21-9-8-15(12-21)11-20(10-14-2-4-16(19)5-3-14)13-17-6-7-18(27-17)22(23)24/h2-7,15H,8-13H2,1H3
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n/an/an/an/a 570n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-Erbalpha expressed in HEK293 cells coexpressing BamII promoter assessed as repression of transcription after 24 hrs by dual-G...


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50388650
PNG
(CHEMBL2059699)
Show SMILES [O-][N+](=O)c1ccc(CN(CC2CCN(C2)S(=O)(=O)Cc2ccccc2)Cc2ccc(Cl)cc2)s1
Show InChI InChI=1S/C24H26ClN3O4S2/c25-22-8-6-19(7-9-22)14-26(17-23-10-11-24(33-23)28(29)30)15-21-12-13-27(16-21)34(31,32)18-20-4-2-1-3-5-20/h1-11,21H,12-18H2
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n/an/an/an/a 630n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-Erbalpha expressed in HEK293 cells coexpressing BamII promoter assessed as repression of transcription after 24 hrs by dual-G...


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50388651
PNG
(CHEMBL2059700)
Show SMILES [O-][N+](=O)c1ccc(CN(CC2CCN(C2)S(=O)(=O)c2cccc3ccccc23)Cc2ccc(Cl)cc2)s1
Show InChI InChI=1S/C27H26ClN3O4S2/c28-23-10-8-20(9-11-23)16-29(19-24-12-13-27(36-24)31(32)33)17-21-14-15-30(18-21)37(34,35)26-7-3-5-22-4-1-2-6-25(22)26/h1-13,21H,14-19H2
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n/an/an/an/a 450n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-Erbalpha expressed in HEK293 cells coexpressing BamII promoter assessed as repression of transcription after 24 hrs by dual-G...


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50388652
PNG
(CHEMBL2059541)
Show SMILES CC(C)(C)OC(=O)CN(Cc1ccc(s1)[N+]([O-])=O)Cc1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C18H21N3O6S/c1-18(2,3)27-17(22)12-19(11-15-8-9-16(28-15)21(25)26)10-13-4-6-14(7-5-13)20(23)24/h4-9H,10-12H2,1-3H3
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n/an/an/an/a 2.50E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-Erbalpha expressed in HEK293 cells coexpressing BamII promoter assessed as repression of transcription after 24 hrs by dual-G...


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50388653
PNG
(CHEMBL2059570)
Show SMILES CC(=O)N1CCC(CN(Cc2ccc(s2)[N+]([O-])=O)Cc2ccc(Cl)cc2)C1
Show InChI InChI=1S/C19H22ClN3O3S/c1-14(24)22-9-8-16(12-22)11-21(10-15-2-4-17(20)5-3-15)13-18-6-7-19(27-18)23(25)26/h2-7,16H,8-13H2,1H3
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n/an/an/an/a 1.60E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-Erbalpha expressed in HEK293 cells coexpressing BamII promoter assessed as repression of transcription after 24 hrs by dual-G...


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50383661
PNG
(CHEMBL2030064)
Show SMILES O=C(N1Cc2ccccc2CC1COCc1ccccc1)c1cccc2ccccc12
Show InChI InChI=1S/C28H25NO2/c30-28(27-16-8-14-22-11-6-7-15-26(22)27)29-18-24-13-5-4-12-23(24)17-25(29)20-31-19-21-9-2-1-3-10-21/h1-16,25H,17-20H2
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n/an/an/an/a 650n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-erbalpha assessed as repression of transcription by luciferase-reporter gene assay


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50383662
PNG
(CHEMBL2029876)
Show SMILES CCOC(=O)C1Cc2ccccc2CN1C(=O)c1cccc2oc(C)cc12
Show InChI InChI=1S/C22H21NO4/c1-3-26-22(25)19-12-15-7-4-5-8-16(15)13-23(19)21(24)17-9-6-10-20-18(17)11-14(2)27-20/h4-11,19H,3,12-13H2,1-2H3
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n/an/an/an/a>3.00E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-erbalpha assessed as repression of transcription by luciferase-reporter gene assay


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50383663
PNG
(CHEMBL2029882)
Show SMILES CCOC(=O)C1Cc2ccccc2CN1C(=O)c1cccc2ccccc12
Show InChI InChI=1S/C23H21NO3/c1-2-27-23(26)21-14-17-9-3-4-10-18(17)15-24(21)22(25)20-13-7-11-16-8-5-6-12-19(16)20/h3-13,21H,2,14-15H2,1H3
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n/an/an/an/a 2.50E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-erbalpha assessed as repression of transcription by luciferase-reporter gene assay


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50383664
PNG
(CHEMBL2029883)
Show SMILES CCOC(=O)C1Cc2ccccc2CN1C(=O)c1cccc2CCCCc12
Show InChI InChI=1S/C23H25NO3/c1-2-27-23(26)21-14-17-9-3-4-10-18(17)15-24(21)22(25)20-13-7-11-16-8-5-6-12-19(16)20/h3-4,7,9-11,13,21H,2,5-6,8,12,14-15H2,1H3
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n/an/an/an/a 2.10E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-erbalpha assessed as repression of transcription by luciferase-reporter gene assay


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50383665
PNG
(CHEMBL2029885)
Show SMILES CCOC(=O)C1Cc2ccccc2CN1S(=O)(=O)c1cccc2ccccc12
Show InChI InChI=1S/C22H21NO4S/c1-2-27-22(24)20-14-17-9-3-4-10-18(17)15-23(20)28(25,26)21-13-7-11-16-8-5-6-12-19(16)21/h3-13,20H,2,14-15H2,1H3
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n/an/an/an/a 1.70E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-erbalpha assessed as repression of transcription by luciferase-reporter gene assay


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50383666
PNG
(CHEMBL2029886)
Show SMILES CCOC(=O)C1Cc2ccccc2CN1S(=O)(=O)c1ccc(C)cc1
Show InChI InChI=1S/C19H21NO4S/c1-3-24-19(21)18-12-15-6-4-5-7-16(15)13-20(18)25(22,23)17-10-8-14(2)9-11-17/h4-11,18H,3,12-13H2,1-2H3
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n/an/an/an/a 1.10E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-erbalpha assessed as repression of transcription by luciferase-reporter gene assay


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50383667
PNG
(CHEMBL2029895)
Show SMILES O=C(NCc1ccccc1)C1Cc2ccccc2CN1C(=O)c1cccc2ccccc12
Show InChI InChI=1S/C28H24N2O2/c31-27(29-18-20-9-2-1-3-10-20)26-17-22-12-4-5-13-23(22)19-30(26)28(32)25-16-8-14-21-11-6-7-15-24(21)25/h1-16,26H,17-19H2,(H,29,31)
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n/an/an/an/a>3.00E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-erbalpha assessed as repression of transcription by luciferase-reporter gene assay


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50383668
PNG
(CHEMBL2029898)
Show SMILES O=C(N1Cc2ccccc2CC1COc1ccccc1)c1cccc2ccccc12
Show InChI InChI=1S/C27H23NO2/c29-27(26-16-8-12-20-9-6-7-15-25(20)26)28-18-22-11-5-4-10-21(22)17-23(28)19-30-24-13-2-1-3-14-24/h1-16,23H,17-19H2
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n/an/an/an/a 840n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-erbalpha assessed as repression of transcription by luciferase-reporter gene assay


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50383669
PNG
(CHEMBL2030065)
Show SMILES O=C(N1Cc2ccccc2CC1COc1cccc2ccccc12)c1cccc2ccccc12
Show InChI InChI=1S/C31H25NO2/c33-31(29-17-7-13-22-9-3-5-15-27(22)29)32-20-25-12-2-1-11-24(25)19-26(32)21-34-30-18-8-14-23-10-4-6-16-28(23)30/h1-18,26H,19-21H2
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n/an/an/an/a 1.20E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-erbalpha assessed as repression of transcription by luciferase-reporter gene assay


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50383670
PNG
(CHEMBL2030069)
Show SMILES O=C(N1Cc2ccccc2CC1CNCc1ccccc1)c1cccc2ccccc12
Show InChI InChI=1S/C28H26N2O/c31-28(27-16-8-14-22-11-6-7-15-26(22)27)30-20-24-13-5-4-12-23(24)17-25(30)19-29-18-21-9-2-1-3-10-21/h1-16,25,29H,17-20H2
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n/an/an/an/a>3.00E+3n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-erbalpha assessed as repression of transcription by luciferase-reporter gene assay


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50383671
PNG
(CHEMBL2030070)
Show SMILES Fc1ccc(OCC2Cc3ccccc3CN2C(=O)c2cccc3ccccc23)cc1
Show InChI InChI=1S/C27H22FNO2/c28-22-12-14-24(15-13-22)31-18-23-16-20-7-1-2-8-21(20)17-29(23)27(30)26-11-5-9-19-6-3-4-10-25(19)26/h1-15,23H,16-18H2
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n/an/an/an/a 800n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-erbalpha assessed as repression of transcription by luciferase-reporter gene assay


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50383672
PNG
(CHEMBL2030071)
Show SMILES O=C(N1Cc2ccccc2CC1COc1ccc(cc1)-c1ccccc1)c1cccc2ccccc12
Show InChI InChI=1S/C33H27NO2/c35-33(32-16-8-14-26-11-6-7-15-31(26)32)34-22-28-13-5-4-12-27(28)21-29(34)23-36-30-19-17-25(18-20-30)24-9-2-1-3-10-24/h1-20,29H,21-23H2
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n/an/an/an/a 650n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-erbalpha assessed as repression of transcription by luciferase-reporter gene assay


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50383673
PNG
(CHEMBL2030072)
Show SMILES COc1ccc(OCC2Cc3ccccc3CN2C(=O)c2cccc3ccccc23)cc1
Show InChI InChI=1S/C28H25NO3/c1-31-24-13-15-25(16-14-24)32-19-23-17-21-8-2-3-9-22(21)18-29(23)28(30)27-12-6-10-20-7-4-5-11-26(20)27/h2-16,23H,17-19H2,1H3
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n/an/an/an/a 120n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-erbalpha assessed as repression of transcription by luciferase-reporter gene assay


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50383674
PNG
(CHEMBL2030073)
Show SMILES CCOc1ccc(OCC2Cc3ccccc3CN2C(=O)c2cccc3ccccc23)cc1
Show InChI InChI=1S/C29H27NO3/c1-2-32-25-14-16-26(17-15-25)33-20-24-18-22-9-3-4-10-23(22)19-30(24)29(31)28-13-7-11-21-8-5-6-12-27(21)28/h3-17,24H,2,18-20H2,1H3
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n/an/an/an/a 97n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-erbalpha assessed as repression of transcription by luciferase-reporter gene assay


Citation and Details
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50383675
PNG
(CHEMBL2030074)
Show SMILES CCCOc1ccc(OCC2Cc3ccccc3CN2C(=O)c2cccc3ccccc23)cc1
Show InChI InChI=1S/C30H29NO3/c1-2-18-33-26-14-16-27(17-15-26)34-21-25-19-23-9-3-4-10-24(23)20-31(25)30(32)29-13-7-11-22-8-5-6-12-28(22)29/h3-17,25H,2,18-21H2,1H3
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n/an/an/an/a 77n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-erbalpha assessed as repression of transcription by luciferase-reporter gene assay


Citation and Details
More data for this
Ligand-Target Pair
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