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Compile Data Set for Download or QSAR

Found 138 hits Enz. Inhib. hit(s) with all data for entry = 2172   
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
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356633
PNG
(1-(3-(9H-carbazol-9-yl)-2-hydroxypropyl)piperidin-...)
Show SMILES OC(CN1CCCCC1=O)Cn1c2ccccc2c2ccccc12
Show InChI InChI=1S/C20H22N2O2/c23-15(13-21-12-6-5-11-20(21)24)14-22-18-9-3-1-7-16(18)17-8-2-4-10-19(17)22/h1-4,7-10,15,23H,5-6,11-14H2
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US Patent


Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356634
PNG
(1-(3-(9H-carbazol- 9-yl)-2- hydroxypropyl)-3- fluo...)
Show SMILES OC(CN1CCCC(F)C1=O)Cn1c2ccccc2c2ccccc12
Show InChI InChI=1S/C20H21FN2O2/c21-17-8-5-11-22(20(17)25)12-14(24)13-23-18-9-3-1-6-15(18)16-7-2-4-10-19(16)23/h1-4,6-7,9-10,14,17,24H,5,8,11-13H2
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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356635
PNG
(1-(3-(9H-carbazol- 9-yl)-2- hydroxypropyl)-3- meth...)
Show SMILES CN1CCCN(CC(O)Cn2c3ccccc3c3ccccc23)C1=O
Show InChI InChI=1S/C20H23N3O2/c1-21-11-6-12-22(20(21)25)13-15(24)14-23-18-9-4-2-7-16(18)17-8-3-5-10-19(17)23/h2-5,7-10,15,24H,6,11-14H2,1H3
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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356636
PNG
(US10214507, Compound 71 | US10759777, Compound 71)
Show SMILES OC(CN1CCCNC1=O)Cn1c2ccc(F)cc2c2cc(F)ccc12
Show InChI InChI=1S/C19H19F2N3O2/c20-12-2-4-17-15(8-12)16-9-13(21)3-5-18(16)24(17)11-14(25)10-23-7-1-6-22-19(23)26/h2-5,8-9,14,25H,1,6-7,10-11H2,(H,22,26)
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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356638
PNG
(1-(3-(9H-carbazol- 9-yl)-2- hydroxypropyl) tetrahy...)
Show SMILES OC(CN1CCCNC1=O)Cn1c2ccccc2c2ccccc12
Show InChI InChI=1S/C19H21N3O2/c23-14(12-21-11-5-10-20-19(21)24)13-22-17-8-3-1-6-15(17)16-7-2-4-9-18(16)22/h1-4,6-9,14,23H,5,10-13H2,(H,20,24)
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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356639
PNG
(1-(3-(3,6-difluoro- 9H-carbazol-9-yl)-2- hydroxypr...)
Show SMILES OC(CN1CCNC1=O)Cn1c2ccc(F)cc2c2cc(F)ccc12
Show InChI InChI=1S/C18H17F2N3O2/c19-11-1-3-16-14(7-11)15-8-12(20)2-4-17(15)23(16)10-13(24)9-22-6-5-21-18(22)25/h1-4,7-8,13,24H,5-6,9-10H2,(H,21,25)
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Reset Therapeutics, Inc.

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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356640
PNG
(1-(3-(3,6-difluoro- 9H-carbazol-9-yl)-2- hydroxypr...)
Show SMILES OC(CN1CCCCC1=O)Cn1c2ccc(F)cc2c2cc(F)ccc12
Show InChI InChI=1S/C20H20F2N2O2/c21-13-4-6-18-16(9-13)17-10-14(22)5-7-19(17)24(18)12-15(25)11-23-8-2-1-3-20(23)26/h4-7,9-10,15,25H,1-3,8,11-12H2
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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356641
PNG
(1-(3-(3,6-difluoro- 9H-carbazol-9-yl)-2- hydroxypr...)
Show SMILES CCN1CCN(CC(O)Cn2c3ccc(F)cc3c3cc(F)ccc23)C1=O
Show InChI InChI=1S/C20H21F2N3O2/c1-2-23-7-8-24(20(23)27)11-15(26)12-25-18-5-3-13(21)9-16(18)17-10-14(22)4-6-19(17)25/h3-6,9-10,15,26H,2,7-8,11-12H2,1H3
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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356642
PNG
(1-(3-(3,6-difluoro- 9H-carbazol-9-yl)-2- hydroxy-2...)
Show SMILES CC(O)(CN1CCCCC1=O)Cn1c2ccc(F)cc2c2cc(F)ccc12
Show InChI InChI=1S/C21H22F2N2O2/c1-21(27,12-24-9-3-2-4-20(24)26)13-25-18-7-5-14(22)10-16(18)17-11-15(23)6-8-19(17)25/h5-8,10-11,27H,2-4,9,12-13H2,1H3
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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356643
PNG
(1-cyclohexyl-3-(3- (3,6-difluoro-9H- carbazol-9-yl...)
Show SMILES OC(CN1CCCN(C2CCCCC2)C1=O)Cn1c2ccc(F)cc2c2cc(F)ccc12
Show InChI InChI=1S/C25H29F2N3O2/c26-17-7-9-23-21(13-17)22-14-18(27)8-10-24(22)30(23)16-20(31)15-28-11-4-12-29(25(28)32)19-5-2-1-3-6-19/h7-10,13-14,19-20,31H,1-6,11-12,15-16H2
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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356644
PNG
(1-(3-(3,6-difluoro- 9H-carbazol-9-yl)-2- hydroxypr...)
Show SMILES CN1CCCN(CC(O)Cn2c3ccc(F)cc3c3cc(F)ccc23)C1=O
Show InChI InChI=1S/C20H21F2N3O2/c1-23-7-2-8-24(20(23)27)11-15(26)12-25-18-5-3-13(21)9-16(18)17-10-14(22)4-6-19(17)25/h3-6,9-10,15,26H,2,7-8,11-12H2,1H3
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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356645
PNG
(1-(3-(3,6-difluoro- 9H-carbazol-9-yl)-2- hydroxypr...)
Show SMILES OC(CN1CCCN(C1=O)c1ccccc1)Cn1c2ccc(F)cc2c2cc(F)ccc12
Show InChI InChI=1S/C25H23F2N3O2/c26-17-7-9-23-21(13-17)22-14-18(27)8-10-24(22)30(23)16-20(31)15-28-11-4-12-29(25(28)32)19-5-2-1-3-6-19/h1-3,5-10,13-14,20,31H,4,11-12,15-16H2
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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356646
PNG
(1-(3-(3,6-difluoro- 9H-carbazol-9-yl)-2- hydroxypr...)
Show SMILES OC(CN1CCCC1=O)Cn1c2ccc(F)cc2c2cc(F)ccc12
Show InChI InChI=1S/C19H18F2N2O2/c20-12-3-5-17-15(8-12)16-9-13(21)4-6-18(16)23(17)11-14(24)10-22-7-1-2-19(22)25/h3-6,8-9,14,24H,1-2,7,10-11H2
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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356648
PNG
(1-cyclopentyl-3-(3- (3,6-difluoro-9H- carbazol-9-y...)
Show SMILES OC(CN1CCCN(C2CCCC2)C1=O)Cn1c2ccc(F)cc2c2cc(F)ccc12
Show InChI InChI=1S/C24H27F2N3O2/c25-16-6-8-22-20(12-16)21-13-17(26)7-9-23(21)29(22)15-19(30)14-27-10-3-11-28(24(27)31)18-4-1-2-5-18/h6-9,12-13,18-19,30H,1-5,10-11,14-15H2
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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356649
PNG
(1-(3-(3,6-difluoro- 9H-carbazol-9-yl)-2- hydroxy-2...)
Show SMILES CC(O)(CN1CCCC1=O)Cn1c2ccc(F)cc2c2cc(F)ccc12
Show InChI InChI=1S/C20H20F2N2O2/c1-20(26,11-23-8-2-3-19(23)25)12-24-17-6-4-13(21)9-15(17)16-10-14(22)5-7-18(16)24/h4-7,9-10,26H,2-3,8,11-12H2,1H3
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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356650
PNG
(1-(3-(3,6-difluoro- 9H-carbazol-9-yl)-2- hydroxypr...)
Show SMILES CC(C)N1CCCN(CC(O)Cn2c3ccc(F)cc3c3cc(F)ccc23)C1=O
Show InChI InChI=1S/C22H25F2N3O2/c1-14(2)26-9-3-8-25(22(26)29)12-17(28)13-27-20-6-4-15(23)10-18(20)19-11-16(24)5-7-21(19)27/h4-7,10-11,14,17,28H,3,8-9,12-13H2,1-2H3
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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356653
PNG
(1-(3-(3,6-difluoro- 9H-carbazol-9-yl)-2- hydroxypr...)
Show SMILES OC(CN1CCC(F)C1=O)Cn1c2ccc(F)cc2c2cc(F)ccc12
Show InChI InChI=1S/C19H17F3N2O2/c20-11-1-3-17-14(7-11)15-8-12(21)2-4-18(15)24(17)10-13(25)9-23-6-5-16(22)19(23)26/h1-4,7-8,13,16,25H,5-6,9-10H2
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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356654
PNG
(1-cyclobutyl-3-(3- (3,6-difluoro-9H- carbazol-9-yl...)
Show SMILES OC(CN1CCCN(C2CCC2)C1=O)Cn1c2ccc(F)cc2c2cc(F)ccc12
Show InChI InChI=1S/C23H25F2N3O2/c24-15-5-7-21-19(11-15)20-12-16(25)6-8-22(20)28(21)14-18(29)13-26-9-2-10-27(23(26)30)17-3-1-4-17/h5-8,11-12,17-18,29H,1-4,9-10,13-14H2
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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356655
PNG
(1-(3-(3,6-difluoro- 9H-carbazol-9-yl)-2- hydroxy-2...)
Show SMILES CC(O)(CN1CCC(F)C1=O)Cn1c2ccc(F)cc2c2cc(F)ccc12
Show InChI InChI=1S/C20H19F3N2O2/c1-20(27,10-24-7-6-16(23)19(24)26)11-25-17-4-2-12(21)8-14(17)15-9-13(22)3-5-18(15)25/h2-5,8-9,16,27H,6-7,10-11H2,1H3
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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356656
PNG
(1-(3-(3,6-difluoro- 9H-carbazol-9-yl)-2- hydroxy-2...)
Show SMILES CC(O)(CN1CCCN(C1=O)c1ccccc1)Cn1c2ccc(F)cc2c2cc(F)ccc12
Show InChI InChI=1S/C26H25F2N3O2/c1-26(33,16-29-12-5-13-30(25(29)32)20-6-3-2-4-7-20)17-31-23-10-8-18(27)14-21(23)22-15-19(28)9-11-24(22)31/h2-4,6-11,14-15,33H,5,12-13,16-17H2,1H3
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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356658
PNG
(1-(3-(3,6-difluoro- 9H-carbazol-9-yl)-2- hydroxypr...)
Show SMILES OC(CN1CCCC(F)C1=O)Cn1c2ccc(F)cc2c2cc(F)ccc12
Show InChI InChI=1S/C20H19F3N2O2/c21-12-3-5-18-15(8-12)16-9-13(22)4-6-19(16)25(18)11-14(26)10-24-7-1-2-17(23)20(24)27/h3-6,8-9,14,17,26H,1-2,7,10-11H2
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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356659
PNG
(1-(3-(3,6-difluoro- 9H-carbazol-9-yl)-2- hydroxy-2...)
Show SMILES CC(C)N1CCCN(CC(C)(O)Cn2c3ccc(F)cc3c3cc(F)ccc23)C1=O
Show InChI InChI=1S/C23H27F2N3O2/c1-15(2)27-10-4-9-26(22(27)29)13-23(3,30)14-28-20-7-5-16(24)11-18(20)19-12-17(25)6-8-21(19)28/h5-8,11-12,15,30H,4,9-10,13-14H2,1-3H3
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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356660
PNG
(1-(3-(3,6-difluoro- 9H-carbazol-9-yl)-2- hydroxy-2...)
Show SMILES CC(O)(CN1CCCC(F)C1=O)Cn1c2ccc(F)cc2c2cc(F)ccc12
Show InChI InChI=1S/C21H21F3N2O2/c1-21(28,11-25-8-2-3-17(24)20(25)27)12-26-18-6-4-13(22)9-15(18)16-10-14(23)5-7-19(16)26/h4-7,9-10,17,28H,2-3,8,11-12H2,1H3
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Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356661
PNG
(1-cyclobutyl-3-(3- (3,6-difluoro-9H- carbazol-9-yl...)
Show SMILES CC(O)(CN1CCCN(C2CCC2)C1=O)Cn1c2ccc(F)cc2c2cc(F)ccc12
Show InChI InChI=1S/C24H27F2N3O2/c1-24(31,14-27-10-3-11-28(23(27)30)18-4-2-5-18)15-29-21-8-6-16(25)12-19(21)20-13-17(26)7-9-22(20)29/h6-9,12-13,18,31H,2-5,10-11,14-15H2,1H3
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Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356663
PNG
(1-(3-(3,6-difluoro- 9H-carbazol-9-yl)-2- hydroxypr...)
Show SMILES OC(CN1CCCC(F)(F)C1=O)Cn1c2ccc(F)cc2c2cc(F)ccc12
Show InChI InChI=1S/C20H18F4N2O2/c21-12-2-4-17-15(8-12)16-9-13(22)3-5-18(16)26(17)11-14(27)10-25-7-1-6-20(23,24)19(25)28/h2-5,8-9,14,27H,1,6-7,10-11H2
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Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356664
PNG
(1-cyclohexyl-3-(3- (3,6-difluoro-9H- carbazol-9-yl...)
Show SMILES CC(O)(CN1CCCN(C2CCCCC2)C1=O)Cn1c2ccc(F)cc2c2cc(F)ccc12
Show InChI InChI=1S/C26H31F2N3O2/c1-26(33,16-29-12-5-13-30(25(29)32)20-6-3-2-4-7-20)17-31-23-10-8-18(27)14-21(23)22-15-19(28)9-11-24(22)31/h8-11,14-15,20,33H,2-7,12-13,16-17H2,1H3
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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356665
PNG
(1-(3-(3,6-difluoro- 9H-carbazol-9-yl)-2- hydroxy-2...)
Show SMILES CC(O)(CN1CCCC(F)(F)C1=O)Cn1c2ccc(F)cc2c2cc(F)ccc12
Show InChI InChI=1S/C21H20F4N2O2/c1-20(29,11-26-8-2-7-21(24,25)19(26)28)12-27-17-5-3-13(22)9-15(17)16-10-14(23)4-6-18(16)27/h3-6,9-10,29H,2,7-8,11-12H2,1H3
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Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356666
PNG
(1-cyclopropyl-3-(3- (3,6-difluoro-9H- carbazol-9-y...)
Show SMILES OC(CN1CCCN(C2CC2)C1=O)Cn1c2ccc(F)cc2c2cc(F)ccc12
Show InChI InChI=1S/C22H23F2N3O2/c23-14-2-6-20-18(10-14)19-11-15(24)3-7-21(19)27(20)13-17(28)12-25-8-1-9-26(22(25)29)16-4-5-16/h2-3,6-7,10-11,16-17,28H,1,4-5,8-9,12-13H2
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Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356668
PNG
(1-(3-(3,6-difluoro- 9H-carbazol-9-yl)-2- hydroxypr...)
Show SMILES CC1(C)CCN(CC(O)Cn2c3ccc(F)cc3c3cc(F)ccc23)C1=O
Show InChI InChI=1S/C21H22F2N2O2/c1-21(2)7-8-24(20(21)27)11-15(26)12-25-18-5-3-13(22)9-16(18)17-10-14(23)4-6-19(17)25/h3-6,9-10,15,26H,7-8,11-12H2,1-2H3
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Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356669
PNG
(1-(3-(9H-carbazol- 9-yl)-2- hydroxypropyl)imid- az...)
Show SMILES OC(CN1CCNC1=O)Cn1c2ccccc2c2ccccc12
Show InChI InChI=1S/C18H19N3O2/c22-13(11-20-10-9-19-18(20)23)12-21-16-7-3-1-5-14(16)15-6-2-4-8-17(15)21/h1-8,13,22H,9-12H2,(H,19,23)
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Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356670
PNG
(1-(3-(3,6-difluoro- 9H-carbazol-9-yl)-2- hydroxypr...)
Show SMILES CC1(C)CCCN(CC(O)Cn2c3ccc(F)cc3c3cc(F)ccc23)C1=O
Show InChI InChI=1S/C22H24F2N2O2/c1-22(2)8-3-9-25(21(22)28)12-16(27)13-26-19-6-4-14(23)10-17(19)18-11-15(24)5-7-20(18)26/h4-7,10-11,16,27H,3,8-9,12-13H2,1-2H3
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Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356671
PNG
(US10214507, Compound 85 | US10759777, Compound 85)
Show SMILES CC1CN(CC(O)Cn2c3ccc(F)cc3c3cc(F)ccc23)C(=O)N1
Show InChI InChI=1S/C19H19F2N3O2/c1-11-8-23(19(26)22-11)9-14(25)10-24-17-4-2-12(20)6-15(17)16-7-13(21)3-5-18(16)24/h2-7,11,14,25H,8-10H2,1H3,(H,22,26)
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Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356672
PNG
(1-(3-(3,6-difluoro- 9H-carbazol-9-yl)-2- hydroxypr...)
Show SMILES CCC1CCN(CC(O)Cn2c3ccc(F)cc3c3cc(F)ccc23)C1=O
Show InChI InChI=1S/C21H22F2N2O2/c1-2-13-7-8-24(21(13)27)11-16(26)12-25-19-5-3-14(22)9-17(19)18-10-15(23)4-6-20(18)25/h3-6,9-10,13,16,26H,2,7-8,11-12H2,1H3
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Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356674
PNG
(US10214507, Compound 86 | US10759777, Compound 86)
Show SMILES CCN1CCCN(CC(O)Cn2c3ccc(F)cc3c3cc(F)ccc23)C1=O
Show InChI InChI=1S/C21H23F2N3O2/c1-2-24-8-3-9-25(21(24)28)12-16(27)13-26-19-6-4-14(22)10-17(19)18-11-15(23)5-7-20(18)26/h4-7,10-11,16,27H,2-3,8-9,12-13H2,1H3
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Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356675
PNG
(3-cyclopentyl-1-(3- (3,6-difluoro-9H- carbazol-9-y...)
Show SMILES OC(CN1CCC(C2CCCC2)C1=O)Cn1c2ccc(F)cc2c2cc(F)ccc12
Show InChI InChI=1S/C24H26F2N2O2/c25-16-5-7-22-20(11-16)21-12-17(26)6-8-23(21)28(22)14-18(29)13-27-10-9-19(24(27)30)15-3-1-2-4-15/h5-8,11-12,15,18-19,29H,1-4,9-10,13-14H2
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Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356676
PNG
(1-(3-(3,6-difluoro- 9H-carbazol-9-yl)-2- hydroxy-2...)
Show SMILES CCN1CCCN(CC(C)(O)Cn2c3ccc(F)cc3c3cc(F)ccc23)C1=O
Show InChI InChI=1S/C22H25F2N3O2/c1-3-25-9-4-10-26(21(25)28)13-22(2,29)14-27-19-7-5-15(23)11-17(19)18-12-16(24)6-8-20(18)27/h5-8,11-12,29H,3-4,9-10,13-14H2,1-2H3
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Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356679
PNG
(1-(3-(3,6-difluoro- 9H-carbazol-9-yl)-2- hydroxypr...)
Show SMILES OC(CN1CCCC(C1=O)c1ccccc1)Cn1c2ccc(F)cc2c2cc(F)ccc12
Show InChI InChI=1S/C26H24F2N2O2/c27-18-8-10-24-22(13-18)23-14-19(28)9-11-25(23)30(24)16-20(31)15-29-12-4-7-21(26(29)32)17-5-2-1-3-6-17/h1-3,5-6,8-11,13-14,20-21,31H,4,7,12,15-16H2
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Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356680
PNG
(1-cyclohexyl-3-(3- (3,6-difluoro-9H- carbazol-9-yl...)
Show SMILES OC(CN1CCN(C2CCCCC2)C1=O)Cn1c2ccc(F)cc2c2cc(F)ccc12
Show InChI InChI=1S/C24H27F2N3O2/c25-16-6-8-22-20(12-16)21-13-17(26)7-9-23(21)29(22)15-19(30)14-27-10-11-28(24(27)31)18-4-2-1-3-5-18/h6-9,12-13,18-19,30H,1-5,10-11,14-15H2
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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356683
PNG
(3-cyclohexyl-1-(3- (3,6-difluoro-9H- carbazol-9-yl...)
Show SMILES OC(CN1CCCC(C2CCCCC2)C1=O)Cn1c2ccc(F)cc2c2cc(F)ccc12
Show InChI InChI=1S/C26H30F2N2O2/c27-18-8-10-24-22(13-18)23-14-19(28)9-11-25(23)30(24)16-20(31)15-29-12-4-7-21(26(29)32)17-5-2-1-3-6-17/h8-11,13-14,17,20-21,31H,1-7,12,15-16H2
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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356684
PNG
(1-(3-(3,6-difluoro- 9H-carbazol-9-yl)-2- hydroxypr...)
Show SMILES OC(CN1CCN(C1=O)c1ccccc1)Cn1c2ccc(F)cc2c2cc(F)ccc12
Show InChI InChI=1S/C24H21F2N3O2/c25-16-6-8-22-20(12-16)21-13-17(26)7-9-23(21)29(22)15-19(30)14-27-10-11-28(24(27)31)18-4-2-1-3-5-18/h1-9,12-13,19,30H,10-11,14-15H2
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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356685
PNG
(3-cyclohexyl-1-(3- (3,6-difluoro-9H- carbazol-9-yl...)
Show SMILES CC(O)(CN1CCCC(C2CCCCC2)C1=O)Cn1c2ccc(F)cc2c2cc(F)ccc12
Show InChI InChI=1S/C27H32F2N2O2/c1-27(33,16-30-13-5-8-21(26(30)32)18-6-3-2-4-7-18)17-31-24-11-9-19(28)14-22(24)23-15-20(29)10-12-25(23)31/h9-12,14-15,18,21,33H,2-8,13,16-17H2,1H3
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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356686
PNG
(1-(3-(3,6-difluoro- 9H-carbazol-9-yl)-2- hydroxypr...)
Show SMILES CC(C)N1CCN(CC(O)Cn2c3ccc(F)cc3c3cc(F)ccc23)C1=O
Show InChI InChI=1S/C21H23F2N3O2/c1-13(2)25-8-7-24(21(25)28)11-16(27)12-26-19-5-3-14(22)9-17(19)18-10-15(23)4-6-20(18)26/h3-6,9-10,13,16,27H,7-8,11-12H2,1-2H3
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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356687
PNG
(1-(3-(3,6-difluoro- 9H-carbazol-9-yl)-2- hydroxypr...)
Show SMILES CC(C)C1CCN(CC(O)Cn2c3ccc(F)cc3c3cc(F)ccc23)C1=O
Show InChI InChI=1S/C22H24F2N2O2/c1-13(2)17-7-8-25(22(17)28)11-16(27)12-26-20-5-3-14(23)9-18(20)19-10-15(24)4-6-21(19)26/h3-6,9-10,13,16-17,27H,7-8,11-12H2,1-2H3
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n/an/an/an/a 261n/an/an/an/a



Reset Therapeutics, Inc.

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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356688
PNG
(1-cyclopentyl-3-(3- (3,6-difluoro-9H- carbazol-9-y...)
Show SMILES OC(CN1CCN(C2CCCC2)C1=O)Cn1c2ccc(F)cc2c2cc(F)ccc12
Show InChI InChI=1S/C23H25F2N3O2/c24-15-5-7-21-19(11-15)20-12-16(25)6-8-22(20)28(21)14-18(29)13-26-9-10-27(23(26)30)17-3-1-2-4-17/h5-8,11-12,17-18,29H,1-4,9-10,13-14H2
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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356691
PNG
(3-cyclopentyl-1-(3- (3,6-difluoro-9H- carbazol-9-y...)
Show SMILES OC(CN1CCCC(C2CCCC2)C1=O)Cn1c2ccc(F)cc2c2cc(F)ccc12
Show InChI InChI=1S/C25H28F2N2O2/c26-17-7-9-23-21(12-17)22-13-18(27)8-10-24(22)29(23)15-19(30)14-28-11-3-6-20(25(28)31)16-4-1-2-5-16/h7-10,12-13,16,19-20,30H,1-6,11,14-15H2
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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356693
PNG
(1-cyclopropyl-3-(3- (3,6-difluoro-9H- carbazol-9-y...)
Show SMILES OC(CN1CCN(C2CC2)C1=O)Cn1c2ccc(F)cc2c2cc(F)ccc12
Show InChI InChI=1S/C21H21F2N3O2/c22-13-1-5-19-17(9-13)18-10-14(23)2-6-20(18)26(19)12-16(27)11-24-7-8-25(21(24)28)15-3-4-15/h1-2,5-6,9-10,15-16,27H,3-4,7-8,11-12H2
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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356694
PNG
(1-(3-(3,6-difluoro- 9H-carbazol-9-yl)-2- hydroxypr...)
Show SMILES CCC1CCCN(CC(O)Cn2c3ccc(F)cc3c3cc(F)ccc23)C1=O
Show InChI InChI=1S/C22H24F2N2O2/c1-2-14-4-3-9-25(22(14)28)12-17(27)13-26-20-7-5-15(23)10-18(20)19-11-16(24)6-8-21(19)26/h5-8,10-11,14,17,27H,2-4,9,12-13H2,1H3
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Reset Therapeutics, Inc.

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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356695
PNG
(1-cyclobutyl-3-(3- (3,6-difluoro-9H- carbazol-9-yl...)
Show SMILES OC(CN1CCN(C2CCC2)C1=O)Cn1c2ccc(F)cc2c2cc(F)ccc12
Show InChI InChI=1S/C22H23F2N3O2/c23-14-4-6-20-18(10-14)19-11-15(24)5-7-21(19)27(20)13-17(28)12-25-8-9-26(22(25)29)16-2-1-3-16/h4-7,10-11,16-17,28H,1-3,8-9,12-13H2
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Reset Therapeutics, Inc.

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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356696
PNG
(1-(3-(3,6-difluoro- 9H-carbazol-9-yl)-2- hydroxypr...)
Show SMILES CC(C)C1CCCN(CC(O)Cn2c3ccc(F)cc3c3cc(F)ccc23)C1=O
Show InChI InChI=1S/C23H26F2N2O2/c1-14(2)18-4-3-9-26(23(18)29)12-17(28)13-27-21-7-5-15(24)10-19(21)20-11-16(25)6-8-22(20)27/h5-8,10-11,14,17-18,28H,3-4,9,12-13H2,1-2H3
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Reset Therapeutics, Inc.

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Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
Period circadian protein homolog 2


(Homo sapiens (Human))
BDBM356697
PNG
(1-(3-(3,6-difluoro- 9H-carbazol-9-yl)-2- hydroxypr...)
Show SMILES CC1CN(C)C(=O)N(CC(O)Cn2c3ccc(F)cc3c3cc(F)ccc23)C1
Show InChI InChI=1S/C21H23F2N3O2/c1-13-9-24(2)21(28)25(10-13)11-16(27)12-26-19-5-3-14(22)7-17(19)18-8-15(23)4-6-20(18)26/h3-8,13,16,27H,9-12H2,1-2H3
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Reset Therapeutics, Inc.

US Patent


Assay Description
Compounds were screened by using a high-throughput circadian assay system as previously described in Zhang, E. E. et al. Cell, 2009, 139, 199-210. In...


US Patent US10214507 (2019)


BindingDB Entry DOI: 10.7270/Q2KH0QMT
More data for this
Ligand-Target Pair
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