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Patent code US10377742

Compile Data Set for Download or QSAR

Found 493 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
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM327885
PNG
(N-(4-(4- cyanophenyl)phenyl)-5- (4-(4- fluorobenzy...)
Show SMILES Fc1ccc(CN2CCN(CC2)C(=O)c2ccc(nc2)C(=O)Nc2ccc(cc2)-c2ccc(cc2)C#N)cc1
Show InChI InChI=1S/C31H26FN5O2/c32-27-10-3-23(4-11-27)21-36-15-17-37(18-16-36)31(39)26-9-14-29(34-20-26)30(38)35-28-12-7-25(8-13-28)24-5-1-22(19-33)2-6-24/h1-14,20H,15-18,21H2,(H,35,38)
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Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM327896
PNG
((6-(4-(4- cyanobenzylcarbamoyl) phenyl)pyridin-3-...)
Show SMILES Fc1ccc(CN2CCN(CC2)C(=O)c2ccc(nc2)-c2ccc(cc2)C(=O)NCc2ccc(cc2)C#N)cc1
Show InChI InChI=1S/C32H28FN5O2/c33-29-12-5-25(6-13-29)22-37-15-17-38(18-16-37)32(40)28-11-14-30(35-21-28)26-7-9-27(10-8-26)31(39)36-20-24-3-1-23(19-34)2-4-24/h1-14,21H,15-18,20,22H2,(H,36,39)
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n/an/an/an/a 750n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM327904
PNG
((6-(3-(4- cyanobenzylcarbamoyl) phenyl)pyridin-3y...)
Show SMILES Fc1ccc(CN2CCN(CC2)C(=O)c2ccc(nc2)-c2cccc(c2)C(=O)NCc2ccc(cc2)C#N)cc1
Show InChI InChI=1S/C32H28FN5O2/c33-29-11-8-25(9-12-29)22-37-14-16-38(17-15-37)32(40)28-10-13-30(35-21-28)26-2-1-3-27(18-26)31(39)36-20-24-6-4-23(19-34)5-7-24/h1-13,18,21H,14-17,20,22H2,(H,36,39)
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n/an/an/an/a 3.00E+3n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM327905
PNG
(N5-(1-(4-cyanobenzyl)- 1H-pyrazol-4-yl)-N2-(1- (4-...)
Show SMILES O=C(NC1CCN(Cc2ccc(cc2)C#N)CC1)c1ccc(cn1)C(=O)Nc1cnn(Cc2ccc(cc2)C#N)c1
Show InChI InChI=1S/C31H28N8O2/c32-15-22-1-5-24(6-2-22)19-38-13-11-27(12-14-38)36-31(41)29-10-9-26(17-34-29)30(40)37-28-18-35-39(21-28)20-25-7-3-23(16-33)4-8-25/h1-10,17-18,21,27H,11-14,19-20H2,(H,36,41)(H,37,40)
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n/an/an/an/a 3.00E+3n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM327912
PNG
(5-(4-(4- fluorobenzyl)piperazine- 1-carbonyl)-N-(4...)
Show SMILES Cc1ccc(Oc2ccc(NC(=O)c3ccc(cn3)C(=O)N3CCN(Cc4ccc(F)cc4)CC3)cc2)cc1
Show InChI InChI=1S/C31H29FN4O3/c1-22-2-11-27(12-3-22)39-28-13-9-26(10-14-28)34-30(37)29-15-6-24(20-33-29)31(38)36-18-16-35(17-19-36)21-23-4-7-25(32)8-5-23/h2-15,20H,16-19,21H2,1H3,(H,34,37)
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n/an/an/an/a<500n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM327921
PNG
(5-(4-(4- fluorobenzyl)piperazine- 1-carbonyl)-N-(4...)
Show SMILES Fc1ccc(CN2CCN(CC2)C(=O)c2ccc(nc2)C(=O)Nc2ccc(cc2)-c2ccsc2)cc1
Show InChI InChI=1S/C28H25FN4O2S/c29-24-6-1-20(2-7-24)18-32-12-14-33(15-13-32)28(35)22-5-10-26(30-17-22)27(34)31-25-8-3-21(4-9-25)23-11-16-36-19-23/h1-11,16-17,19H,12-15,18H2,(H,31,34)
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n/an/an/an/a<500n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM327937
PNG
(N-(1-(4- cyanobenzyl)piperidin-4- yl)-5-(4-(4- met...)
Show SMILES COc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(=O)c1ccc(nc1)C(=O)NC1CCN(Cc2ccc(cc2)C#N)CC1
Show InChI InChI=1S/C31H34N6O5S/c1-42-27-7-9-28(10-8-27)43(40,41)37-18-16-36(17-19-37)31(39)25-6-11-29(33-21-25)30(38)34-26-12-14-35(15-13-26)22-24-4-2-23(20-32)3-5-24/h2-11,21,26H,12-19,22H2,1H3,(H,34,38)
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n/an/an/an/a 750n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM327938
PNG
(5-(4-benzoylpiperazine- 1-carbonyl)-N-(1-(4- cyano...)
Show SMILES O=C(NC1CCN(Cc2ccc(cc2)C#N)CC1)c1ccc(cn1)C(=O)N1CCN(CC1)C(=O)c1ccccc1
Show InChI InChI=1S/C31H32N6O3/c32-20-23-6-8-24(9-7-23)22-35-14-12-27(13-15-35)34-29(38)28-11-10-26(21-33-28)31(40)37-18-16-36(17-19-37)30(39)25-4-2-1-3-5-25/h1-11,21,27H,12-19,22H2,(H,34,38)
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n/an/an/an/a 3.00E+3n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM327942
PNG
(N-(1-(4- cyanobenzyl)piperidin-4- yl)-5-(4- isopro...)
Show SMILES CC(C)N1CCN(CC1)C(=O)c1ccc(nc1)C(=O)NC1CCN(Cc2ccc(cc2)C#N)CC1
Show InChI InChI=1S/C27H34N6O2/c1-20(2)32-13-15-33(16-14-32)27(35)23-7-8-25(29-18-23)26(34)30-24-9-11-31(12-10-24)19-22-5-3-21(17-28)4-6-22/h3-8,18,20,24H,9-16,19H2,1-2H3,(H,30,34)
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n/an/an/an/a 3.00E+3n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM327972
PNG
(5-(biphenyl-4-ylamino)- N-(1-(4- cyanobenzyl)piper...)
Show SMILES O=C(NC1CCN(Cc2ccc(cc2)C#N)CC1)c1ccc(Nc2ccc(cc2)-c2ccccc2)cn1
Show InChI InChI=1S/C31H29N5O/c32-20-23-6-8-24(9-7-23)22-36-18-16-28(17-19-36)35-31(37)30-15-14-29(21-33-30)34-27-12-10-26(11-13-27)25-4-2-1-3-5-25/h1-15,21,28,34H,16-19,22H2,(H,35,37)
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n/an/an/an/a 7.50E+3n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM327975
PNG
(N-(1-benzylpiperidin-4- yl)-5-(3- phenoxyphenylami...)
Show SMILES O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(Nc2cccc(Oc3ccccc3)c2)cn1
Show InChI InChI=1S/C30H30N4O2/c35-30(33-24-16-18-34(19-17-24)22-23-8-3-1-4-9-23)29-15-14-26(21-31-29)32-25-10-7-13-28(20-25)36-27-11-5-2-6-12-27/h1-15,20-21,24,32H,16-19,22H2,(H,33,35)
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n/an/an/an/a 3.00E+3n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM327989
PNG
(N-(1-(4- cyanobenzyl)piperidin-4- yl)-5-(1-phenylp...)
Show SMILES O=C(NC1CCN(Cc2ccc(cc2)C#N)CC1)c1ccc(NC2CCN(CC2)c2ccccc2)cn1
Show InChI InChI=1S/C30H34N6O/c31-20-23-6-8-24(9-7-23)22-35-16-12-26(13-17-35)34-30(37)29-11-10-27(21-32-29)33-25-14-18-36(19-15-25)28-4-2-1-3-5-28/h1-11,21,25-26,33H,12-19,22H2,(H,34,37)
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n/an/an/an/a<500n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328002
PNG
(5-(1-(4- chlorophenyl)piperidin- 4-ylamino)-N-(1-(...)
Show SMILES Clc1ccc(cc1)N1CCC(CC1)Nc1ccc(nc1)C(=O)NC1CCN(Cc2ccc(cc2)C#N)CC1
Show InChI InChI=1S/C30H33ClN6O/c31-24-5-8-28(9-6-24)37-17-13-25(14-18-37)34-27-7-10-29(33-20-27)30(38)35-26-11-15-36(16-12-26)21-23-3-1-22(19-32)2-4-23/h1-10,20,25-26,34H,11-18,21H2,(H,35,38)
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n/an/an/an/a<500n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328009
PNG
(N-(1-(4- cyanobenzyl)piperidin-4- yl)-5-(4-(3-fluo...)
Show SMILES COc1ccc(CC2CCN(CC2)C(=O)c2ccc(nc2)C(=O)NC2CCN(Cc3ccc(cc3)C#N)CC2)cc1F
Show InChI InChI=1S/C33H36FN5O3/c1-42-31-9-6-26(19-29(31)34)18-23-10-16-39(17-11-23)33(41)27-7-8-30(36-21-27)32(40)37-28-12-14-38(15-13-28)22-25-4-2-24(20-35)3-5-25/h2-9,19,21,23,28H,10-18,22H2,1H3,(H,37,40)
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n/an/an/an/a<500n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328012
PNG
(N-(cis-4-(4- cyanophenoxy) cyclohexyl)-5-(4-(4- f...)
Show SMILES Fc1ccc(CN2CCN(CC2)C(=O)c2ccc(nc2)C(=O)N[C@H]2CC[C@H](CC2)Oc2ccc(cc2)C#N)cc1
Show InChI InChI=1S/C31H32FN5O3/c32-25-6-1-23(2-7-25)21-36-15-17-37(18-16-36)31(39)24-5-14-29(34-20-24)30(38)35-26-8-12-28(13-9-26)40-27-10-3-22(19-33)4-11-27/h1-7,10-11,14,20,26,28H,8-9,12-13,15-18,21H2,(H,35,38)/t26-,28+
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n/an/an/an/a<500n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328026
PNG
(US10377742, Compound 164 | US9663496, Compound 164...)
Show SMILES CC(C)(C)OC(=O)NCC#Cc1cc(cnc1C(=O)NC1CCN(Cc2ccc(cc2)C#N)CC1)C(=O)N1CCN(Cc2ccc(F)cc2)CC1
Show InChI InChI=1S/C39H44FN7O4/c1-39(2,3)51-38(50)42-16-4-5-31-23-32(37(49)47-21-19-46(20-22-47)27-30-10-12-33(40)13-11-30)25-43-35(31)36(48)44-34-14-17-45(18-15-34)26-29-8-6-28(24-41)7-9-29/h6-13,23,25,34H,14-22,26-27H2,1-3H3,(H,42,50)(H,44,48)
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n/an/an/an/a 750n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328032
PNG
(N-(5-(4-(4- fluorobenzyl)piperazine- 1-carbonyl)py...)
Show SMILES Fc1ccc(CN2CCN(CC2)C(=O)c2ccc(NC(=O)c3ccc(cc3)-c3ccccc3)nc2)cc1
Show InChI InChI=1S/C30H27FN4O2/c31-27-13-6-22(7-14-27)21-34-16-18-35(19-17-34)30(37)26-12-15-28(32-20-26)33-29(36)25-10-8-24(9-11-25)23-4-2-1-3-5-23/h1-15,20H,16-19,21H2,(H,32,33,36)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328045
PNG
(N-(1-(4- fluorobenzyl)piperidin- 4-yl)-5-(4-(4- me...)
Show SMILES COc1ccc(OC2CCN(CC2)C(=O)c2ccc(nc2)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)cc1
Show InChI InChI=1S/C31H35FN4O4/c1-39-26-7-9-27(10-8-26)40-28-14-18-36(19-15-28)31(38)23-4-11-29(33-20-23)30(37)34-25-12-16-35(17-13-25)21-22-2-5-24(32)6-3-22/h2-11,20,25,28H,12-19,21H2,1H3,(H,34,37)
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n/an/an/an/a<500n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328048
PNG
(N-((cis)-4-(4- methoxyphenoxy) cyclohexyl)-5-(4-(...)
Show SMILES COc1ccc(O[C@@H]2CC[C@@H](CC2)NC(=O)c2ccc(cn2)C(=O)N2CCC(CC2)Oc2ccc(OC)cc2)cc1
Show InChI InChI=1S/C32H37N3O6/c1-38-24-8-12-27(13-9-24)40-26-6-4-23(5-7-26)34-31(36)30-16-3-22(21-33-30)32(37)35-19-17-29(18-20-35)41-28-14-10-25(39-2)11-15-28/h3,8-16,21,23,26,29H,4-7,17-20H2,1-2H3,(H,34,36)/t23-,26+
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Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328049
PNG
((4-(4- fluorobenzyl)piperazin- 1-yl)(6-(4-(4- (tri...)
Show SMILES Fc1ccc(CN2CCN(CC2)C(=O)c2ccc(nc2)N2CCC(CC2)Oc2ccc(cc2)C(F)(F)F)cc1
Show InChI InChI=1S/C29H30F4N4O2/c30-24-6-1-21(2-7-24)20-35-15-17-37(18-16-35)28(38)22-3-10-27(34-19-22)36-13-11-26(12-14-36)39-25-8-4-23(5-9-25)29(31,32)33/h1-10,19,26H,11-18,20H2
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n/an/an/an/a 3.00E+3n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328052
PNG
(N-((cis)-4-(4- cyanophenoxy) cyclohexyl)-5-(4-(4-...)
Show SMILES FC(F)(F)c1ccc(OC2CCN(CC2)C(=O)c2ccc(nc2)C(=O)N[C@H]2CC[C@H](CC2)Oc2ccc(cc2)C#N)cc1
Show InChI InChI=1S/C32H31F3N4O4/c33-32(34,35)23-4-10-26(11-5-23)43-28-15-17-39(18-16-28)31(41)22-3-14-29(37-20-22)30(40)38-24-6-12-27(13-7-24)42-25-8-1-21(19-36)2-9-25/h1-5,8-11,14,20,24,27-28H,6-7,12-13,15-18H2,(H,38,40)/t24-,27+
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n/an/an/an/a<500n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328066
PNG
(N-(6-(4- fluorophenoxy)pyridin- 3-yl)-5-(4-(4- met...)
Show SMILES COc1ccc(cc1)C(=O)C1CCN(CC1)C(=O)c1cnc(cn1)C(=O)Nc1ccc(Oc2ccc(F)cc2)nc1
Show InChI InChI=1S/C30H26FN5O5/c1-40-23-7-2-19(3-8-23)28(37)20-12-14-36(15-13-20)30(39)26-18-32-25(17-33-26)29(38)35-22-6-11-27(34-16-22)41-24-9-4-21(31)5-10-24/h2-11,16-18,20H,12-15H2,1H3,(H,35,38)
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n/an/an/an/a<500n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328072
PNG
(5-(3-(4- cyanophenoxy)azetidine- 1-carbonyl)-N-(6-...)
Show SMILES Fc1ccc(Oc2ccc(NC(=O)c3ccc(cn3)C(=O)N3CC(C3)Oc3ccc(cc3)C#N)cn2)cc1
Show InChI InChI=1S/C28H20FN5O4/c29-20-4-9-23(10-5-20)38-26-12-6-21(15-32-26)33-27(35)25-11-3-19(14-31-25)28(36)34-16-24(17-34)37-22-7-1-18(13-30)2-8-22/h1-12,14-15,24H,16-17H2,(H,33,35)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM409196
PNG
(N-(1-(4-fluorobenzyl)piperidin-4-yl)-6-(4- (4-(met...)
Show SMILES Cc1ccc(cc1)C(=O)C1CCN(CC1)C(=O)c1ccc(cn1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1
Show InChI InChI=1S/C32H35FN4O3/c1-22-2-6-24(7-3-22)30(38)25-12-18-37(19-13-25)32(40)29-11-8-26(20-34-29)31(39)35-28-14-16-36(17-15-28)21-23-4-9-27(33)10-5-23/h2-11,20,25,28H,12-19,21H2,1H3,(H,35,39)
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n/an/an/an/a 3.00E+3n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328109
PNG
(6-(4-(4- (cyclopropylsulfonyl) phenoxy)piperidine...)
Show SMILES Fc1ccc(Oc2ccc(NC(=O)c3ccc(nc3)C(=O)N3CCC(CC3)Oc3ccc(cc3)S(=O)(=O)C3CC3)cn2)cc1
Show InChI InChI=1S/C32H29FN4O6S/c33-22-2-5-25(6-3-22)43-30-14-4-23(20-35-30)36-31(38)21-1-13-29(34-19-21)32(39)37-17-15-26(16-18-37)42-24-7-9-27(10-8-24)44(40,41)28-11-12-28/h1-10,13-14,19-20,26,28H,11-12,15-18H2,(H,36,38)
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Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM409226
PNG
(N-((trans)-1-(4-cyanobenzyl)-3- fluoropiperidin-4-...)
Show SMILES Cc1ccc(cc1)C(=O)C1CCN(CC1)C(=O)c1ccc(nc1)C(=O)N[C@@H]1CCN(Cc2ccc(cc2)C#N)C[C@H]1F
Show InChI InChI=1S/C33H34FN5O3/c1-22-2-8-25(9-3-22)31(40)26-12-16-39(17-13-26)33(42)27-10-11-30(36-19-27)32(41)37-29-14-15-38(21-28(29)34)20-24-6-4-23(18-35)5-7-24/h2-11,19,26,28-29H,12-17,20-21H2,1H3,(H,37,41)/t28-,29-/m1/s1
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n/an/an/an/a 750n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328129
PNG
(N-(1-(4- cyanobenzyl)piperidin-4- yl)-5-(1-(4- cya...)
Show SMILES O=C(NC1CCN(Cc2ccc(cc2)C#N)CC1)c1ccc(NC2CCN(CC2)c2ccc(cc2)C#N)cn1
Show InChI InChI=1S/C31H33N7O/c32-19-23-1-3-25(4-2-23)22-37-15-11-27(12-16-37)36-31(39)30-10-7-28(21-34-30)35-26-13-17-38(18-14-26)29-8-5-24(20-33)6-9-29/h1-10,21,26-27,35H,11-18,22H2,(H,36,39)
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Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328137
PNG
(N-(1-(4- cyanobenzyl)piperidin-4- yl)-5-(1-(4- met...)
Show SMILES COc1ccc(cc1)N1CCC(CC1)Nc1ccc(nc1)C(=O)NC1CCN(Cc2ccc(cc2)C#N)CC1
Show InChI InChI=1S/C31H36N6O2/c1-39-29-9-7-28(8-10-29)37-18-14-25(15-19-37)34-27-6-11-30(33-21-27)31(38)35-26-12-16-36(17-13-26)22-24-4-2-23(20-32)3-5-24/h2-11,21,25-26,34H,12-19,22H2,1H3,(H,35,38)
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Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328139
PNG
(N-(1-(4- cyanobenzyl)piperidin-4- yl)-5-(3-(3- met...)
Show SMILES COc1cccc(OC2CCCN(C2)C(=O)c2ccc(nc2)C(=O)NC2CCN(Cc3ccc(cc3)C#N)CC2)c1
Show InChI InChI=1S/C32H35N5O4/c1-40-27-4-2-5-28(18-27)41-29-6-3-15-37(22-29)32(39)25-11-12-30(34-20-25)31(38)35-26-13-16-36(17-14-26)21-24-9-7-23(19-33)8-10-24/h2,4-5,7-12,18,20,26,29H,3,6,13-17,21-22H2,1H3,(H,35,38)
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Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328145
PNG
(N-(1-(4- cyanobenzyl)piperidin-4- yl)-5-(4-(pyridi...)
Show SMILES O=C(NC1CCN(Cc2ccc(cc2)C#N)CC1)c1ccc(cn1)C(=O)N1CCC(CC1)Oc1cccnc1
Show InChI InChI=1S/C30H32N6O3/c31-18-22-3-5-23(6-4-22)21-35-14-9-25(10-15-35)34-29(37)28-8-7-24(19-33-28)30(38)36-16-11-26(12-17-36)39-27-2-1-13-32-20-27/h1-8,13,19-20,25-26H,9-12,14-17,21H2,(H,34,37)
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Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328168
PNG
(5-(4-(4-cyanophenoxy) piperidine-1-carbonyl)- N-(...)
Show SMILES Fc1ccc(OCCNC(=O)c2ccc(cn2)C(=O)N2CCC(CC2)Oc2ccc(cc2)C#N)cc1
Show InChI InChI=1S/C27H25FN4O4/c28-21-4-8-22(9-5-21)35-16-13-30-26(33)25-10-3-20(18-31-25)27(34)32-14-11-24(12-15-32)36-23-6-1-19(17-29)2-7-23/h1-10,18,24H,11-16H2,(H,30,33)
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Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328170
PNG
(N-(1-(3,5- difluorobenzyl)piperidin- 4-yl)-5-(3-(4...)
Show SMILES Fc1ccc(COC2CN(C2)C(=O)c2ccc(nc2)C(=O)NC2CCN(Cc3cc(F)cc(F)c3)CC2)cc1
Show InChI InChI=1S/C29H29F3N4O3/c30-22-4-1-19(2-5-22)18-39-26-16-36(17-26)29(38)21-3-6-27(33-14-21)28(37)34-25-7-9-35(10-8-25)15-20-11-23(31)13-24(32)12-20/h1-6,11-14,25-26H,7-10,15-18H2,(H,34,37)
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Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM409295
PNG
(N-((cis)-4-(4-cyanophenoxy)cyclohexyl)-6- (4-(4-cy...)
Show SMILES O=C(N[C@H]1CC[C@H](CC1)Oc1ccc(cc1)C#N)c1ccc(nc1)C(=O)N1CCC(CC1)Oc1ccc(cc1)C#N
Show InChI InChI=1S/C32H31N5O4/c33-19-22-1-8-26(9-2-22)40-28-12-6-25(7-13-28)36-31(38)24-5-14-30(35-21-24)32(39)37-17-15-29(16-18-37)41-27-10-3-23(20-34)4-11-27/h1-5,8-11,14,21,25,28-29H,6-7,12-13,15-18H2,(H,36,38)/t25-,28+
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Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328185
PNG
(N-(1-(4- cyanobenzyl)piperidin-4- yl)-6-(4-(4- cya...)
Show SMILES O=C(NC1CCN(Cc2ccc(cc2)C#N)CC1)c1ccc(nc1)C(=O)N1CCC(CC1)Oc1ccc(cc1)C#N
Show InChI InChI=1S/C32H32N6O3/c33-19-23-1-3-25(4-2-23)22-37-15-11-27(12-16-37)36-31(39)26-7-10-30(35-21-26)32(40)38-17-13-29(14-18-38)41-28-8-5-24(20-34)6-9-28/h1-10,21,27,29H,11-18,22H2,(H,36,39)
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Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328199
PNG
(6-(4-(4-cyanophenoxy) piperidine-1-carbonyl)- N-(...)
Show SMILES O=C(NC1CCN(Cc2ccc(cc2)N2CCOCC2)CC1)c1ccc(nc1)C(=O)N1CCC(CC1)Oc1ccc(cc1)C#N
Show InChI InChI=1S/C35H40N6O4/c36-23-26-3-8-31(9-4-26)45-32-13-17-41(18-14-32)35(43)33-10-5-28(24-37-33)34(42)38-29-11-15-39(16-12-29)25-27-1-6-30(7-2-27)40-19-21-44-22-20-40/h1-10,24,29,32H,11-22,25H2,(H,38,42)
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Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328200
PNG
(6-(4-(4-cyanophenoxy) piperidine-1-carbonyl)- N-(...)
Show SMILES FC(F)(F)Oc1ccc(CN2CCC(CC2)NC(=O)c2ccc(nc2)C(=O)N2CCC(CC2)Oc2ccc(cc2)C#N)cc1
Show InChI InChI=1S/C32H32F3N5O4/c33-32(34,35)44-28-8-3-23(4-9-28)21-39-15-11-25(12-16-39)38-30(41)24-5-10-29(37-20-24)31(42)40-17-13-27(14-18-40)43-26-6-1-22(19-36)2-7-26/h1-10,20,25,27H,11-18,21H2,(H,38,41)
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Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328213
PNG
(N-(1-(4- cyanobenzyl)piperidin-4- yl)-6-(4-(4- cya...)
Show SMILES O=C(NC1CCN(Cc2ccc(cc2)C#N)CC1)c1ccc(nn1)N1CCC(CC1)Oc1ccc(cc1)C#N
Show InChI InChI=1S/C30H31N7O2/c31-19-22-1-3-24(4-2-22)21-36-15-11-25(12-16-36)33-30(38)28-9-10-29(35-34-28)37-17-13-27(14-18-37)39-26-7-5-23(20-32)6-8-26/h1-10,25,27H,11-18,21H2,(H,33,38)
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Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM409326
PNG
(N-((trans)-3-fluoro-1-(4-(pyrrolidin-1- yl)benzyl)...)
Show SMILES COc1ccc(cc1)C(=O)C1CCN(CC1)C(=O)c1ccc(cn1)C(=O)N[C@@H]1CCN(Cc2ccc(cc2)N2CCCC2)C[C@H]1F
Show InChI InChI=1S/C36H42FN5O4/c1-46-30-11-6-26(7-12-30)34(43)27-14-20-42(21-15-27)36(45)33-13-8-28(22-38-33)35(44)39-32-16-19-40(24-31(32)37)23-25-4-9-29(10-5-25)41-17-2-3-18-41/h4-13,22,27,31-32H,2-3,14-21,23-24H2,1H3,(H,39,44)/t31-,32-/m1/s1
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n/an/an/an/a<500n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328217
PNG
(6-(4-(4-cyanophenoxy) piperidine-1-carbonyl)- N-(...)
Show SMILES O=C(NC1CCN(Cc2cocn2)CC1)c1ccc(nc1)C(=O)N1CCC(CC1)Oc1ccc(cc1)C#N
Show InChI InChI=1S/C28H30N6O4/c29-15-20-1-4-24(5-2-20)38-25-9-13-34(14-10-25)28(36)26-6-3-21(16-30-26)27(35)32-22-7-11-33(12-8-22)17-23-18-37-19-31-23/h1-6,16,18-19,22,25H,7-14,17H2,(H,32,35)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328234
PNG
(N-(1-(4- cyanobenzyl)piperidin-4- yl)-5-(4-(4- (me...)
Show SMILES CSc1ccc(cc1)C(=O)C1CCN(CC1)C(=O)c1ccc(nc1)C(=O)NC1CCN(Cc2ccc(cc2)C#N)CC1
Show InChI InChI=1S/C33H35N5O3S/c1-42-29-9-6-25(7-10-29)31(39)26-12-18-38(19-13-26)33(41)27-8-11-30(35-21-27)32(40)36-28-14-16-37(17-15-28)22-24-4-2-23(20-34)3-5-24/h2-11,21,26,28H,12-19,22H2,1H3,(H,36,40)
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n/an/an/an/a<500n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328247
PNG
(N-(1-(4- cyanobenzyl)piperidin-4- yl)-6-(4-(2- (di...)
Show SMILES COc1ccc(OC2CCN(CC2)C(=O)c2ccc(cn2)C(=O)NC2CCN(Cc3ccc(cc3)C#N)CC2)c(c1)N(C)C
Show InChI InChI=1S/C34H40N6O4/c1-38(2)31-20-29(43-3)9-11-32(31)44-28-14-18-40(19-15-28)34(42)30-10-8-26(22-36-30)33(41)37-27-12-16-39(17-13-27)23-25-6-4-24(21-35)5-7-25/h4-11,20,22,27-28H,12-19,23H2,1-3H3,(H,37,41)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328248
PNG
(N3,N6-bis(1-(4- cyanobenzyl)piperidin-4- yl)pyrida...)
Show SMILES O=C(NC1CCN(Cc2ccc(cc2)C#N)CC1)c1ccc(nn1)C(=O)NC1CCN(Cc2ccc(cc2)C#N)CC1
Show InChI InChI=1S/C32H34N8O2/c33-19-23-1-5-25(6-2-23)21-39-15-11-27(12-16-39)35-31(41)29-9-10-30(38-37-29)32(42)36-28-13-17-40(18-14-28)22-26-7-3-24(20-34)4-8-26/h1-10,27-28H,11-18,21-22H2,(H,35,41)(H,36,42)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328249
PNG
(N-(1-(4- cyanobenzyl)piperidin-4- yl)-6-(4-(4- met...)
Show SMILES COc1ccc(cc1)C(=O)C1CCN(CC1)C(=O)c1ccc(nn1)C(=O)NC1CCN(Cc2ccc(cc2)C#N)CC1
Show InChI InChI=1S/C32H34N6O4/c1-42-27-8-6-24(7-9-27)30(39)25-12-18-38(19-13-25)32(41)29-11-10-28(35-36-29)31(40)34-26-14-16-37(17-15-26)21-23-4-2-22(20-33)3-5-23/h2-11,25-26H,12-19,21H2,1H3,(H,34,40)
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n/an/an/an/a<500n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328255
PNG
(6-(4-(4-(1H-pyrazol-1- yl)benzoyl)piperidine-1- ca...)
Show SMILES O=C(NC1CCN(Cc2ccc(cc2)C#N)CC1)c1ccc(nc1)C(=O)N1CCC(CC1)C(=O)c1ccc(cc1)-n1cccn1
Show InChI InChI=1S/C35H35N7O3/c36-22-25-2-4-26(5-3-25)24-40-18-14-30(15-19-40)39-34(44)29-8-11-32(37-23-29)35(45)41-20-12-28(13-21-41)33(43)27-6-9-31(10-7-27)42-17-1-16-38-42/h1-11,16-17,23,28,30H,12-15,18-21,24H2,(H,39,44)
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n/an/an/an/a<500n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328263
PNG
(N-(1-(4- acetamidobenzyl) piperidin-4-yl)-6-(4-(4...)
Show SMILES COc1ccc(cc1)C(=O)C1CCN(CC1)C(=O)c1ccc(cn1)C(=O)NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1
Show InChI InChI=1S/C34H39N5O5/c1-23(40)36-28-8-3-24(4-9-28)22-38-17-15-29(16-18-38)37-33(42)27-7-12-31(35-21-27)34(43)39-19-13-26(14-20-39)32(41)25-5-10-30(44-2)11-6-25/h3-12,21,26,29H,13-20,22H2,1-2H3,(H,36,40)(H,37,42)
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n/an/an/an/a 3.00E+3n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328272
PNG
(N-(1-(4- cyanobenzyl)piperidin-4- yl)-5-(4-(4- (tr...)
Show SMILES FC(F)(F)Sc1ccc(OC2CCN(CC2)C(=O)c2ccc(nc2)C(=O)NC2CCN(Cc3ccc(cc3)C#N)CC2)cc1
Show InChI InChI=1S/C32H32F3N5O3S/c33-32(34,35)44-28-8-6-26(7-9-28)43-27-13-17-40(18-14-27)31(42)24-5-10-29(37-20-24)30(41)38-25-11-15-39(16-12-25)21-23-3-1-22(19-36)2-4-23/h1-10,20,25,27H,11-18,21H2,(H,38,41)
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n/an/an/an/a<500n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328273
PNG
(6-(4-(3- acetamidophenoxy) piperidine-1-carbonyl)...)
Show SMILES CC(=O)Nc1cccc(OC2CCN(CC2)C(=O)c2ccc(cn2)C(=O)NC2CCN(Cc3ccc(cc3)C#N)CC2)c1
Show InChI InChI=1S/C33H36N6O4/c1-23(40)36-28-3-2-4-30(19-28)43-29-13-17-39(18-14-29)33(42)31-10-9-26(21-35-31)32(41)37-27-11-15-38(16-12-27)22-25-7-5-24(20-34)6-8-25/h2-10,19,21,27,29H,11-18,22H2,1H3,(H,36,40)(H,37,41)
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n/an/an/an/a 3.00E+3n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328278
PNG
(US10377742, Compound 416 | US9663496, Compound 416...)
Show SMILES COc1ccc(cc1)C(=O)C1CCN(CC1)C(=O)c1ncc(cc1CCCNC(=O)OC(C)(C)C)C(=O)NC1CCN(Cc2ccc(cc2)C#N)CC1
Show InChI InChI=1S/C41H50N6O6/c1-41(2,3)53-40(51)43-19-5-6-32-24-33(38(49)45-34-17-20-46(21-18-34)27-29-9-7-28(25-42)8-10-29)26-44-36(32)39(50)47-22-15-31(16-23-47)37(48)30-11-13-35(52-4)14-12-30/h7-14,24,26,31,34H,5-6,15-23,27H2,1-4H3,(H,43,51)(H,45,49)
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n/an/an/an/a 3.00E+3n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM409416
PNG
(N-((cis)-4-(4-cyanophenoxy)cyclohexyl)-6- (4-(4-(p...)
Show SMILES O=C(N[C@H]1CC[C@H](CC1)Oc1ccc(cc1)C#N)c1ccc(nc1)C(=O)N1CCC(CC1)C(=O)c1ccc(cc1)N1CCCC1
Show InChI InChI=1S/C36H39N5O4/c37-23-25-3-12-31(13-4-25)45-32-14-8-29(9-15-32)39-35(43)28-7-16-33(38-24-28)36(44)41-21-17-27(18-22-41)34(42)26-5-10-30(11-6-26)40-19-1-2-20-40/h3-7,10-13,16,24,27,29,32H,1-2,8-9,14-15,17-22H2,(H,39,43)/t29-,32+
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n/an/an/an/a<500n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
5'-AMP-activated protein kinase catalytic subunit alpha-2


(Homo sapiens (Human))
BDBM328308
PNG
(N-(1-(4- isopropoxybenzyl) piperidin-4-yl)-6-(4-(...)
Show SMILES CC(C)Oc1ccc(CN2CCC(CC2)NC(=O)c2ccc(nc2)C(=O)N2CCC(CC2)C(=O)c2ccc(cc2)N2CCCC2)cc1
Show InChI InChI=1S/C38H47N5O4/c1-27(2)47-34-12-5-28(6-13-34)26-41-21-17-32(18-22-41)40-37(45)31-9-14-35(39-25-31)38(46)43-23-15-30(16-24-43)36(44)29-7-10-33(11-8-29)42-19-3-4-20-42/h5-14,25,27,30,32H,3-4,15-24,26H2,1-2H3,(H,40,45)
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n/an/an/an/a<500n/an/an/an/a



Rigel Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for their ability to activate AMPK using an enzyme-linked immunosorbent assay. Reagents and procedures for measuring AMPK acti...


US Patent US10377742 (2019)


BindingDB Entry DOI: 10.7270/Q2RV0R22
More data for this
Ligand-Target Pair
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