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Patent code US9187462

Compile Data Set for Download or QSAR
Found 122 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
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192361
PNG
(US9187462, I-41)
Show SMILES Cn1cc(cn1)[C@@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)c1ccc(OC(F)F)cc1 |r|
Show InChI InChI=1S/C26H26F2N6O3/c1-34-15-19(14-30-34)23(16-4-6-21(7-5-16)37-25(27)28)33-24(35)17-2-3-18-13-29-26(32-22(18)12-17)31-20-8-10-36-11-9-20/h2-7,12-15,20,23,25H,8-11H2,1H3,(H,33,35)(H,29,31,32)/t23-/m0/s1
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n/an/a 0.550n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192385
PNG
(US9187462, I-65)
Show SMILES Cn1cc(cn1)[C@@H](NC(=O)c1cc(F)c2cnc(NC3CCOCC3)nc2c1)c1ccc(C#N)c(Cl)c1 |r|
Show InChI InChI=1S/C26H23ClFN7O2/c1-35-14-18(12-31-35)24(15-2-3-16(11-29)21(27)8-15)34-25(36)17-9-22(28)20-13-30-26(33-23(20)10-17)32-19-4-6-37-7-5-19/h2-3,8-10,12-14,19,24H,4-7H2,1H3,(H,34,36)(H,30,32,33)/t24-/m0/s1
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n/an/a 0.600n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192386
PNG
(US9187462, I-66)
Show SMILES COc1ccc(cc1Cl)[C@H](NC(=O)c1cc(F)c2cnc(NC3CCOCC3)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C26H26ClFN6O3/c1-34-14-17(12-30-34)24(15-3-4-23(36-2)20(27)9-15)33-25(35)16-10-21(28)19-13-29-26(32-22(19)11-16)31-18-5-7-37-8-6-18/h3-4,9-14,18,24H,5-8H2,1-2H3,(H,33,35)(H,29,31,32)/t24-/m0/s1
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n/an/a 0.600n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192322
PNG
(US9187462, I-2)
Show SMILES Cn1cc(cn1)C(NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)c1ccc(Cl)c(F)c1
Show InChI InChI=1S/C25H24ClFN6O2/c1-33-14-18(13-29-33)23(15-4-5-20(26)21(27)10-15)32-24(34)16-2-3-17-12-28-25(31-22(17)11-16)30-19-6-8-35-9-7-19/h2-5,10-14,19,23H,6-9H2,1H3,(H,32,34)(H,28,30,31)
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n/an/a 0.800n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192364
PNG
(US9187462, I-44)
Show SMILES COc1ccc(cc1Cl)[C@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C26H27ClN6O3/c1-33-15-19(14-29-33)24(16-5-6-23(35-2)21(27)11-16)32-25(34)17-3-4-18-13-28-26(31-22(18)12-17)30-20-7-9-36-10-8-20/h3-6,11-15,20,24H,7-10H2,1-2H3,(H,32,34)(H,28,30,31)/t24-/m0/s1
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n/an/a 1n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192368
PNG
(US9187462, I-48)
Show SMILES Cn1cc(cn1)[C@@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)c1ccc(C#N)c(Cl)c1 |r|
Show InChI InChI=1S/C26H24ClN7O2/c1-34-15-20(14-30-34)24(16-2-4-18(12-28)22(27)10-16)33-25(35)17-3-5-19-13-29-26(32-23(19)11-17)31-21-6-8-36-9-7-21/h2-5,10-11,13-15,21,24H,6-9H2,1H3,(H,33,35)(H,29,31,32)/t24-/m0/s1
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n/an/a 1.10n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192436
PNG
(US9187462, II-46)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(NC3CCOCC3)nc2c1)c1cncn1C |r|
Show InChI InChI=1S/C26H26F2N6O3/c1-34-14-29-13-22(34)24(15-3-4-23(36-2)20(28)9-15)33-25(35)16-10-19(27)18-12-30-26(32-21(18)11-16)31-17-5-7-37-8-6-17/h3-4,9-14,17,24H,5-8H2,1-2H3,(H,33,35)(H,30,31,32)/t24-/m0/s1
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n/an/a 1.10n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192352
PNG
(US9187462, I-32)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C26H27FN6O3/c1-33-15-19(14-29-33)24(16-5-6-23(35-2)21(27)11-16)32-25(34)17-3-4-18-13-28-26(31-22(18)12-17)30-20-7-9-36-10-8-20/h3-6,11-15,20,24H,7-10H2,1-2H3,(H,32,34)(H,28,30,31)/t24-/m0/s1
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n/an/a 1.10n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192335
PNG
(US9187462, I-15)
Show SMILES CC(CO)Nc1ncc2ccc(cc2n1)C(=O)N[C@H](c1cnn(C)c1)c1ccc(Cl)c(F)c1 |r|
Show InChI InChI=1S/C23H22ClFN6O2/c1-13(12-32)28-23-26-9-16-4-3-15(8-20(16)29-23)22(33)30-21(17-10-27-31(2)11-17)14-5-6-18(24)19(25)7-14/h3-11,13,21,32H,12H2,1-2H3,(H,30,33)(H,26,28,29)/t13?,21-/m0/s1
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n/an/a 1.20n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192389
PNG
(US9187462, I-69)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(N[C@H]3CC[C@H](O)CC3)nc2c1)c1cnn(C)c1 |r,wU:22.22,wD:9.10,25.26,(11.38,-2.65,;10.05,-3.42,;8.72,-2.65,;7.34,-3.39,;6,-2.62,;6,-1.08,;7.34,-.31,;8.67,-1.08,;10,-.31,;4.67,-.31,;3.33,-1.08,;2,-.31,;2,1.23,;.67,-1.08,;.67,-2.62,;-.67,-3.39,;-.67,-4.93,;-2,-2.62,;-3.33,-3.39,;-4.67,-2.62,;-4.67,-1.08,;-6,-.31,;-7.34,-1.08,;-7.34,-2.62,;-8.67,-3.39,;-10,-2.62,;-11.34,-3.39,;-10,-1.08,;-8.67,-.31,;-3.33,-.31,;-2,-1.08,;-.67,-.31,;4.67,1.23,;3.42,2.13,;3.9,3.6,;5.46,3.63,;6.37,4.88,;5.91,2.13,)|
Show InChI InChI=1S/C27H28F2N6O3/c1-35-14-17(12-31-35)25(15-3-8-24(38-2)22(29)9-15)34-26(37)16-10-21(28)20-13-30-27(33-23(20)11-16)32-18-4-6-19(36)7-5-18/h3,8-14,18-19,25,36H,4-7H2,1-2H3,(H,34,37)(H,30,32,33)/t18-,19-,25-/m0/s1
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Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192388
PNG
(BDBM192402 | US9187462, I-68)
Show SMILES Cn1cc(cn1)[C@@H](NC(=O)c1cc(F)c2cnc(NC3CCOCC3)nc2c1)c1cccc(F)c1 |r|
Show InChI InChI=1S/C25H24F2N6O2/c1-33-14-17(12-29-33)23(15-3-2-4-18(26)9-15)32-24(34)16-10-21(27)20-13-28-25(31-22(20)11-16)30-19-5-7-35-8-6-19/h2-4,9-14,19,23H,5-8H2,1H3,(H,32,34)(H,28,30,31)/t23-/m0/s1
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n/an/a 1.20n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192403
PNG
(US9187462, II-13)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(N[C@H]3CC[C@H](O)CC3)nc2c1)c1cnn(C)c1 |r,wU:22.22,9.10,wD:25.26,(9.38,1.49,;8.05,2.26,;6.72,1.49,;5.33,2.24,;4,1.47,;4,-.07,;5.33,-.84,;6.67,-.07,;8,-.84,;2.67,-.84,;1.33,-.07,;1.33,1.47,;2.67,2.24,;,2.24,;,3.78,;-1.33,4.55,;-1.33,6.09,;-2.67,3.78,;-4,4.55,;-5.33,3.78,;-5.33,2.24,;-6.67,1.47,;-6.67,-.07,;-5.33,-.84,;-5.33,-2.38,;-6.67,-3.15,;-6.67,-4.69,;-8,-2.38,;-8,-.84,;-4,1.47,;-2.67,2.24,;-1.33,1.47,;2.67,-2.38,;3.91,-3.29,;3.44,-4.75,;1.87,-4.79,;.97,-6.03,;1.42,-3.29,)|
Show InChI InChI=1S/C27H28F2N6O3/c1-35-14-17(12-31-35)25(15-3-8-24(38-2)22(29)9-15)34-26(37)16-10-21(28)20-13-30-27(33-23(20)11-16)32-18-4-6-19(36)7-5-18/h3,8-14,18-19,25,36H,4-7H2,1-2H3,(H,34,37)(H,30,32,33)/t18-,19-,25-/m0/s1
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n/an/a 1.20n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192359
PNG
(US9187462, I-39)
Show SMILES Fc1ccc(cc1Cl)[C@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)[C@@]1(F)CCNC1 |r|
Show InChI InChI=1S/C25H26ClF2N5O2/c26-19-11-15(3-4-20(19)27)22(25(28)7-8-29-14-25)33-23(34)16-1-2-17-13-30-24(32-21(17)12-16)31-18-5-9-35-10-6-18/h1-4,11-13,18,22,29H,5-10,14H2,(H,33,34)(H,30,31,32)/t22-,25+/m0/s1
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n/an/a 1.20n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192388
PNG
(BDBM192402 | US9187462, I-68)
Show SMILES Cn1cc(cn1)[C@@H](NC(=O)c1cc(F)c2cnc(NC3CCOCC3)nc2c1)c1cccc(F)c1 |r|
Show InChI InChI=1S/C25H24F2N6O2/c1-33-14-17(12-29-33)23(15-3-2-4-18(26)9-15)32-24(34)16-10-21(27)20-13-28-25(31-22(20)11-16)30-19-5-7-35-8-6-19/h2-4,9-14,19,23H,5-8H2,1H3,(H,32,34)(H,28,30,31)/t23-/m0/s1
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n/an/a 1.30n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192437
PNG
(US9187462, II-47)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(NC3CCOCC3)nc2c1)c1cnco1 |r|
Show InChI InChI=1S/C25H23F2N5O4/c1-34-21-3-2-14(8-19(21)27)23(22-12-28-13-36-22)32-24(33)15-9-18(26)17-11-29-25(31-20(17)10-15)30-16-4-6-35-7-5-16/h2-3,8-13,16,23H,4-7H2,1H3,(H,32,33)(H,29,30,31)/t23-/m0/s1
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n/an/a 1.30n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192438
PNG
(US9187462, II-48)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(NC3CCOCC3)nc2c1)c1cnnn1C |r|
Show InChI InChI=1S/C25H25F2N7O3/c1-34-21(13-29-33-34)23(14-3-4-22(36-2)19(27)9-14)32-24(35)15-10-18(26)17-12-28-25(31-20(17)11-15)30-16-5-7-37-8-6-16/h3-4,9-13,16,23H,5-8H2,1-2H3,(H,32,35)(H,28,30,31)/t23-/m0/s1
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n/an/a 1.40n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192342
PNG
(US9187462, I-22)
Show SMILES Cn1ccc(n1)[C@@H](NC(=O)c1cc(F)c2cnc(NC3CCOCC3)nc2c1)c1ccc(Cl)c(F)c1 |r|
Show InChI InChI=1S/C25H23ClF2N6O2/c1-34-7-4-21(33-34)23(14-2-3-18(26)20(28)10-14)32-24(35)15-11-19(27)17-13-29-25(31-22(17)12-15)30-16-5-8-36-9-6-16/h2-4,7,10-13,16,23H,5-6,8-9H2,1H3,(H,32,35)(H,29,30,31)/t23-/m0/s1
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n/an/a 1.40n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192332
PNG
(US9187462, I-12)
Show SMILES Cn1cc(cn1)[C@@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)c1ccc(Cl)c(F)c1 |r|
Show InChI InChI=1S/C25H24ClFN6O2/c1-33-14-18(13-29-33)23(15-4-5-20(26)21(27)10-15)32-24(34)16-2-3-17-12-28-25(31-22(17)11-16)30-19-6-8-35-9-7-19/h2-5,10-14,19,23H,6-9H2,1H3,(H,32,34)(H,28,30,31)/t23-/m0/s1
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n/an/a 1.40n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192367
PNG
(US9187462, I-47)
Show SMILES Cn1cc(cn1)[C@@H](NC(=O)c1ccc2cnc(N[C@@H]3CCO[C@H](CO)C3)nc2c1)c1ccc(Cl)c(F)c1 |r|
Show InChI InChI=1S/C26H26ClFN6O3/c1-34-13-18(12-30-34)24(15-4-5-21(27)22(28)8-15)33-25(36)16-2-3-17-11-29-26(32-23(17)9-16)31-19-6-7-37-20(10-19)14-35/h2-5,8-9,11-13,19-20,24,35H,6-7,10,14H2,1H3,(H,33,36)(H,29,31,32)/t19-,20+,24+/m1/s1
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n/an/a 1.40n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192353
PNG
(US9187462, I-33)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(NC3CCOCC3)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C26H26F2N6O3/c1-34-14-17(12-30-34)24(15-3-4-23(36-2)21(28)9-15)33-25(35)16-10-20(27)19-13-29-26(32-22(19)11-16)31-18-5-7-37-8-6-18/h3-4,9-14,18,24H,5-8H2,1-2H3,(H,33,35)(H,29,31,32)/t24-/m0/s1
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n/an/a 1.5n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192443
PNG
(US9187462, II-53)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(Nc3ccnn3C)nc2c1)c1cncn1C |r|
Show InChI InChI=1S/C25H22F2N8O2/c1-34-13-28-12-20(34)23(14-4-5-21(37-3)18(27)8-14)33-24(36)15-9-17(26)16-11-29-25(31-19(16)10-15)32-22-6-7-30-35(22)2/h4-13,23H,1-3H3,(H,33,36)(H,29,31,32)/t23-/m0/s1
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n/an/a 1.5n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192356
PNG
(US9187462, I-36)
Show SMILES Fc1ccc(cc1Cl)[C@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)[C@]1(F)CCNC1 |r|
Show InChI InChI=1S/C25H26ClF2N5O2/c26-19-11-15(3-4-20(19)27)22(25(28)7-8-29-14-25)33-23(34)16-1-2-17-13-30-24(32-21(17)12-16)31-18-5-9-35-10-6-18/h1-4,11-13,18,22,29H,5-10,14H2,(H,33,34)(H,30,31,32)/t22-,25-/m0/s1
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n/an/a 1.60n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192351
PNG
(US9187462, I-31)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)[C@H]1C[C@H](F)CN1 |r|
Show InChI InChI=1S/C26H29F2N5O3/c1-35-23-5-4-15(10-20(23)28)24(22-12-18(27)14-29-22)33-25(34)16-2-3-17-13-30-26(32-21(17)11-16)31-19-6-8-36-9-7-19/h2-5,10-11,13,18-19,22,24,29H,6-9,12,14H2,1H3,(H,33,34)(H,30,31,32)/t18-,22+,24-/m0/s1
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n/an/a 1.70n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192327
PNG
(US9187462, I-7)
Show SMILES Fc1cc(ccc1C(F)(F)F)[C@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)[C@H]1CCCN1 |r|
Show InChI InChI=1S/C26H27F4N5O2/c27-20-12-15(5-6-19(20)26(28,29)30)23(21-2-1-9-31-21)35-24(36)16-3-4-17-14-32-25(34-22(17)13-16)33-18-7-10-37-11-8-18/h3-6,12-14,18,21,23,31H,1-2,7-11H2,(H,35,36)(H,32,33,34)/t21-,23+/m1/s1
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n/an/a 1.80n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192442
PNG
(US9187462, II-52)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(NC3CCOCC3)nc2c1)c1nccn1C |r|
Show InChI InChI=1S/C26H26F2N6O3/c1-34-8-7-29-24(34)23(15-3-4-22(36-2)20(28)11-15)33-25(35)16-12-19(27)18-14-30-26(32-21(18)13-16)31-17-5-9-37-10-6-17/h3-4,7-8,11-14,17,23H,5-6,9-10H2,1-2H3,(H,33,35)(H,30,31,32)/t23-/m0/s1
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n/an/a 1.90n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192346
PNG
(US9187462, I-26)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1ccc2cnc(N[C@H](C)C3CC3)nc2c1)[C@H]1CCCN1 |r|
Show InChI InChI=1S/C26H30FN5O2/c1-15(16-5-6-16)30-26-29-14-19-8-7-18(13-22(19)31-26)25(33)32-24(21-4-3-11-28-21)17-9-10-23(34-2)20(27)12-17/h7-10,12-16,21,24,28H,3-6,11H2,1-2H3,(H,32,33)(H,29,30,31)/t15-,21-,24+/m1/s1
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n/an/a 2n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192381
PNG
(US9187462, I-61)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(N[C@@H]3CCOC3)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C25H24F2N6O3/c1-33-12-16(10-29-33)23(14-3-4-22(35-2)20(27)7-14)32-24(34)15-8-19(26)18-11-28-25(31-21(18)9-15)30-17-5-6-36-13-17/h3-4,7-12,17,23H,5-6,13H2,1-2H3,(H,32,34)(H,28,30,31)/t17-,23+/m1/s1
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n/an/a 2n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192355
PNG
(US9187462, I-35)
Show SMILES C[C@@H]1CC[C@@H](N1)[C@@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)c1ccc(Cl)c(F)c1 |r|
Show InChI InChI=1S/C26H29ClFN5O2/c1-15-2-7-22(30-15)24(16-5-6-20(27)21(28)12-16)33-25(34)17-3-4-18-14-29-26(32-23(18)13-17)31-19-8-10-35-11-9-19/h3-6,12-15,19,22,24,30H,2,7-11H2,1H3,(H,33,34)(H,29,31,32)/t15-,22-,24+/m1/s1
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n/an/a 2n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192340
PNG
(US9187462, I-20)
Show SMILES Cn1ccc(n1)[C@@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)c1ccc(Cl)c(F)c1 |r|
Show InChI InChI=1S/C25H24ClFN6O2/c1-33-9-6-21(32-33)23(15-4-5-19(26)20(27)12-15)31-24(34)16-2-3-17-14-28-25(30-22(17)13-16)29-18-7-10-35-11-8-18/h2-6,9,12-14,18,23H,7-8,10-11H2,1H3,(H,31,34)(H,28,29,30)/t23-/m0/s1
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n/an/a 2n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192323
PNG
(US9187462, I-3)
Show SMILES Fc1cc(ccc1C(F)(F)F)[C@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)[C@@H]1CCCN1 |r|
Show InChI InChI=1S/C26H27F4N5O2/c27-20-12-15(5-6-19(20)26(28,29)30)23(21-2-1-9-31-21)35-24(36)16-3-4-17-14-32-25(34-22(17)13-16)33-18-7-10-37-11-8-18/h3-6,12-14,18,21,23,31H,1-2,7-11H2,(H,35,36)(H,32,33,34)/t21-,23-/m0/s1
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n/an/a 2.10n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192406
PNG
(US9187462, II-16)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1ccc2cnc(Nc3ccnn3C)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C25H23FN8O2/c1-33-14-18(13-29-33)23(15-6-7-21(36-3)19(26)10-15)32-24(35)16-4-5-17-12-27-25(30-20(17)11-16)31-22-8-9-28-34(22)2/h4-14,23H,1-3H3,(H,32,35)(H,27,30,31)/t23-/m0/s1
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n/an/a 2.10n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192408
PNG
(US9187462, II-18)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1ccc2cnc(Nc3cc(C)nn3C)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C26H25FN8O2/c1-15-9-23(35(3)33-15)31-26-28-12-18-6-5-17(11-21(18)30-26)25(36)32-24(19-13-29-34(2)14-19)16-7-8-22(37-4)20(27)10-16/h5-14,24H,1-4H3,(H,32,36)(H,28,30,31)/t24-/m0/s1
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n/an/a 2.10n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192350
PNG
(US9187462, I-30)
Show SMILES Cn1cc(cn1)[C@@H](NC(=O)c1ccc2cnc(N[C@@H]3CCOC[C@H]3F)nc2c1)c1ccc(Cl)c(F)c1 |r|
Show InChI InChI=1S/C25H23ClF2N6O2/c1-34-12-17(11-30-34)23(14-4-5-18(26)19(27)8-14)33-24(35)15-2-3-16-10-29-25(32-22(16)9-15)31-21-6-7-36-13-20(21)28/h2-5,8-12,20-21,23H,6-7,13H2,1H3,(H,33,35)(H,29,31,32)/t20-,21-,23+/m1/s1
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n/an/a 2.10n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192419
PNG
(US9187462, II-29)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(NC3CCOCC3)nc2c1)c1ccnn1C |r|
Show InChI InChI=1S/C26H26F2N6O3/c1-34-22(5-8-30-34)24(15-3-4-23(36-2)20(28)11-15)33-25(35)16-12-19(27)18-14-29-26(32-21(18)13-16)31-17-6-9-37-10-7-17/h3-5,8,11-14,17,24H,6-7,9-10H2,1-2H3,(H,33,35)(H,29,31,32)/t24-/m0/s1
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n/an/a 2.20n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192343
PNG
(US9187462, I-23)
Show SMILES Fc1cc(ccc1Cl)[C@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)[C@H]1CCCN1 |r|
Show InChI InChI=1S/C25H27ClFN5O2/c26-19-6-5-15(12-20(19)27)23(21-2-1-9-28-21)32-24(33)16-3-4-17-14-29-25(31-22(17)13-16)30-18-7-10-34-11-8-18/h3-6,12-14,18,21,23,28H,1-2,7-11H2,(H,32,33)(H,29,30,31)/t21-,23+/m1/s1
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n/an/a 2.30n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192411
PNG
(US9187462, II-21)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(N[C@@H](C)CO)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C24H24F2N6O3/c1-13(12-33)29-24-27-10-17-18(25)7-15(8-20(17)30-24)23(34)31-22(16-9-28-32(2)11-16)14-4-5-21(35-3)19(26)6-14/h4-11,13,22,33H,12H2,1-3H3,(H,31,34)(H,27,29,30)/t13-,22-/m0/s1
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n/an/a 2.30n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192325
PNG
(US9187462, I-5)
Show SMILES CC(C)Nc1ncc2ccc(cc2n1)C(=O)N[C@H]([C@H]1CCCN1)c1ccc(c(F)c1)C(F)(F)F |r|
Show InChI InChI=1S/C24H25F4N5O/c1-13(2)31-23-30-12-16-6-5-15(11-20(16)32-23)22(34)33-21(19-4-3-9-29-19)14-7-8-17(18(25)10-14)24(26,27)28/h5-8,10-13,19,21,29H,3-4,9H2,1-2H3,(H,33,34)(H,30,31,32)/t19-,21+/m1/s1
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n/an/a 2.30n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192339
PNG
(US9187462, I-19)
Show SMILES Fc1cc(ccc1Cl)[C@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)c1cc[nH]n1 |r|
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n/an/a 2.40n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192348
PNG
(US9187462, I-28)
Show SMILES Cn1cc(cn1)[C@@H](NC(=O)c1ccc2cnc(N[C@H]3CCOC[C@H]3F)nc2c1)c1ccc(Cl)c(F)c1 |r|
Show InChI InChI=1S/C25H23ClF2N6O2/c1-34-12-17(11-30-34)23(14-4-5-18(26)19(27)8-14)33-24(35)15-2-3-16-10-29-25(32-22(16)9-15)31-21-6-7-36-13-20(21)28/h2-5,8-12,20-21,23H,6-7,13H2,1H3,(H,33,35)(H,29,31,32)/t20-,21+,23+/m1/s1
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n/an/a 2.5n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192321
PNG
(US9187462, I-1)
Show SMILES CC(CO)Nc1ncc2ccc(cc2n1)C(=O)NC(c1cnn(C)c1)c1ccc(Cl)c(F)c1
Show InChI InChI=1S/C23H22ClFN6O2/c1-13(12-32)28-23-26-9-16-4-3-15(8-20(16)29-23)22(33)30-21(17-10-27-31(2)11-17)14-5-6-18(24)19(25)7-14/h3-11,13,21,32H,12H2,1-2H3,(H,30,33)(H,26,28,29)
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n/an/a 2.5n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192372
PNG
(US9187462, I-52)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(N[C@H]3CCOC[C@H]3F)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C26H25F3N6O3/c1-35-12-16(10-31-35)24(14-3-4-23(37-2)19(28)7-14)34-25(36)15-8-18(27)17-11-30-26(33-22(17)9-15)32-21-5-6-38-13-20(21)29/h3-4,7-12,20-21,24H,5-6,13H2,1-2H3,(H,34,36)(H,30,32,33)/t20-,21+,24+/m1/s1
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n/an/a 2.60n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192375
PNG
(US9187462, I-55)
Show SMILES Cn1cc(cn1)[C@@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C25H24ClFN6O2/c1-33-14-18(13-29-33)23(15-4-5-21(27)20(26)10-15)32-24(34)16-2-3-17-12-28-25(31-22(17)11-16)30-19-6-8-35-9-7-19/h2-5,10-14,19,23H,6-9H2,1H3,(H,32,34)(H,28,30,31)/t23-/m0/s1
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n/an/a 2.70n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192337
PNG
(US9187462, I-17)
Show SMILES CN1CCC[C@@H]1[C@@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)c1ccc(c(F)c1)C(F)(F)F |r|
Show InChI InChI=1S/C27H29F4N5O2/c1-36-10-2-3-23(36)24(16-6-7-20(21(28)13-16)27(29,30)31)35-25(37)17-4-5-18-15-32-26(34-22(18)14-17)33-19-8-11-38-12-9-19/h4-7,13-15,19,23-24H,2-3,8-12H2,1H3,(H,35,37)(H,32,33,34)/t23-,24+/m1/s1
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n/an/a 2.80n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192371
PNG
(US9187462, I-51)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(NC3CCOCC3)nc2c1)c1cnn(C)n1 |r|
Show InChI InChI=1S/C25H25F2N7O3/c1-34-29-13-21(33-34)23(14-3-4-22(36-2)19(27)9-14)32-24(35)15-10-18(26)17-12-28-25(31-20(17)11-15)30-16-5-7-37-8-6-16/h3-4,9-13,16,23H,5-8H2,1-2H3,(H,32,35)(H,28,30,31)/t23-/m0/s1
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n/an/a 2.80n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192428
PNG
(US9187462, II-38)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1ccc2cnc(Nc3ccnn3C)nc2c1)c1ccnn1C |r|
Show InChI InChI=1S/C25H23FN8O2/c1-33-20(8-10-28-33)23(15-6-7-21(36-3)18(26)12-15)32-24(35)16-4-5-17-14-27-25(30-19(17)13-16)31-22-9-11-29-34(22)2/h4-14,23H,1-3H3,(H,32,35)(H,27,30,31)/t23-/m0/s1
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n/an/a 2.90n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192418
PNG
(US9187462, II-28)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)c1ccnn1C |r|
Show InChI InChI=1S/C26H27FN6O3/c1-33-22(7-10-29-33)24(16-5-6-23(35-2)20(27)13-16)32-25(34)17-3-4-18-15-28-26(31-21(18)14-17)30-19-8-11-36-12-9-19/h3-7,10,13-15,19,24H,8-9,11-12H2,1-2H3,(H,32,34)(H,28,30,31)/t24-/m0/s1
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n/an/a 3n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192415
PNG
(US9187462, II-25)
Show SMILES Cn1cc(cn1)[C@@H](NC(=O)c1ccc2cnc(Nc3ccnn3C)nc2c1)c1ccc(Cl)c(F)c1 |r|
Show InChI InChI=1S/C24H20ClFN8O/c1-33-13-17(12-29-33)22(14-5-6-18(25)19(26)9-14)32-23(35)15-3-4-16-11-27-24(30-20(16)10-15)31-21-7-8-28-34(21)2/h3-13,22H,1-2H3,(H,32,35)(H,27,30,31)/t22-/m0/s1
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n/an/a 3.10n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192376
PNG
(US9187462, I-56)
Show SMILES COc1ccc(cc1C#N)[C@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C27H27N7O3/c1-34-16-21(15-30-34)25(17-5-6-24(36-2)20(11-17)13-28)33-26(35)18-3-4-19-14-29-27(32-23(19)12-18)31-22-7-9-37-10-8-22/h3-6,11-12,14-16,22,25H,7-10H2,1-2H3,(H,33,35)(H,29,31,32)/t25-/m0/s1
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n/an/a 3.5n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192354
PNG
(US9187462, I-34)
Show SMILES Fc1cc(ccc1Cl)C(NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)c1ncno1
Show InChI InChI=1S/C23H20ClFN6O3/c24-17-4-3-13(9-18(17)25)20(22-27-12-28-34-22)31-21(32)14-1-2-15-11-26-23(30-19(15)10-14)29-16-5-7-33-8-6-16/h1-4,9-12,16,20H,5-8H2,(H,31,32)(H,26,29,30)
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n/an/a 3.60n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192427
PNG
(US9187462, II-37)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1ccc2cnc(N[C@H]3CCOC[C@@H]3F)nc2c1)c1ccnn1C |r|
Show InChI InChI=1S/C26H26F2N6O3/c1-34-22(7-9-30-34)24(15-5-6-23(36-2)18(27)11-15)33-25(35)16-3-4-17-13-29-26(32-21(17)12-16)31-20-8-10-37-14-19(20)28/h3-7,9,11-13,19-20,24H,8,10,14H2,1-2H3,(H,33,35)(H,29,31,32)/t19-,20-,24-/m0/s1
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n/an/a 3.60n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192426
PNG
(US9187462, II-36)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1ccc2cnc(N[C@H]3CCOC[C@H]3F)nc2c1)c1ccnn1C |r|
Show InChI InChI=1S/C26H26F2N6O3/c1-34-22(7-9-30-34)24(15-5-6-23(36-2)18(27)11-15)33-25(35)16-3-4-17-13-29-26(32-21(17)12-16)31-20-8-10-37-14-19(20)28/h3-7,9,11-13,19-20,24H,8,10,14H2,1-2H3,(H,33,35)(H,29,31,32)/t19-,20+,24+/m1/s1
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n/an/a 3.80n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192399
PNG
(US9187462, II-9)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1ccc2cnc(N[C@H]3C[C@H](O)C3)nc2c1)c1cnn(C)c1 |r,wU:21.21,wD:9.10,23.24,(10.99,-2.65,;9.66,-3.42,;8.33,-2.65,;8.28,-1.08,;6.94,-.31,;5.61,-1.08,;5.61,-2.62,;6.94,-3.39,;6.94,-4.93,;4.28,-.31,;2.94,-1.08,;1.61,-.31,;1.61,1.23,;.28,-1.08,;.28,-2.62,;-1.06,-3.39,;-2.39,-2.62,;-3.72,-3.39,;-5.06,-2.62,;-5.06,-1.08,;-6.39,-.31,;-7.73,-1.08,;-8.12,-2.57,;-9.61,-2.17,;-10.95,-2.94,;-9.21,-.68,;-3.72,-.31,;-2.39,-1.08,;-1.06,-.31,;4.28,1.23,;3.03,2.13,;3.51,3.6,;5.07,3.63,;5.98,4.88,;5.52,2.13,)|
Show InChI InChI=1S/C25H25FN6O3/c1-32-13-17(12-28-32)23(14-5-6-22(35-2)20(26)7-14)31-24(34)15-3-4-16-11-27-25(30-21(16)8-15)29-18-9-19(33)10-18/h3-8,11-13,18-19,23,33H,9-10H2,1-2H3,(H,31,34)(H,27,29,30)/t18-,19-,23-/m0/s1
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n/an/a 3.80n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192349
PNG
(US9187462, I-29)
Show SMILES Cn1cc(cn1)[C@@H](NC(=O)c1ccc2cnc(N[C@H]3CCOC[C@@H]3F)nc2c1)c1ccc(Cl)c(F)c1 |r|
Show InChI InChI=1S/C25H23ClF2N6O2/c1-34-12-17(11-30-34)23(14-4-5-18(26)19(27)8-14)33-24(35)15-2-3-16-10-29-25(32-22(16)9-15)31-21-6-7-36-13-20(21)28/h2-5,8-12,20-21,23H,6-7,13H2,1H3,(H,33,35)(H,29,31,32)/t20-,21-,23-/m0/s1
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n/an/a 3.80n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192423
PNG
(US9187462, II-33)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(N[C@@H]3C[C@H](F)C3)nc2c1)c1cnn(OC)c1 |r,wU:22.22,9.10,24.25,(9.26,1.5,;7.93,2.27,;6.59,1.49,;5.21,2.24,;3.88,1.47,;3.88,-.07,;5.21,-.84,;6.55,-.07,;7.88,-.84,;2.55,-.84,;1.21,-.07,;1.21,1.47,;2.55,2.24,;-.12,2.24,;-.12,3.78,;-1.46,4.55,;-1.46,6.09,;-2.79,3.78,;-4.12,4.55,;-5.46,3.78,;-5.46,2.24,;-6.79,1.47,;-6.79,-.07,;-7.88,-1.16,;-6.79,-2.25,;-6.79,-3.79,;-5.7,-1.16,;-4.12,1.47,;-2.79,2.24,;-1.46,1.47,;2.55,-2.38,;1.3,-3.29,;1.78,-4.75,;3.34,-4.79,;4.24,-6.03,;5.78,-5.87,;3.79,-3.29,)|
Show InChI InChI=1S/C25H23F3N6O3/c1-36-22-4-3-13(5-20(22)28)23(15-10-30-34(12-15)37-2)33-24(35)14-6-19(27)18-11-29-25(32-21(18)7-14)31-17-8-16(26)9-17/h3-7,10-12,16-17,23H,8-9H2,1-2H3,(H,33,35)(H,29,31,32)/t16-,17+,23-/m0/s1
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n/an/a 3.80n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192382
PNG
(US9187462, I-62)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(N[C@H]3CCOC3)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C25H24F2N6O3/c1-33-12-16(10-29-33)23(14-3-4-22(35-2)20(27)7-14)32-24(34)15-8-19(26)18-11-28-25(31-21(18)9-15)30-17-5-6-36-13-17/h3-4,7-12,17,23H,5-6,13H2,1-2H3,(H,32,34)(H,28,30,31)/t17-,23-/m0/s1
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n/an/a 4n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192390
PNG
(BDBM192405 | US9187462, I-70 | US9187462, II-15)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(N[C@@H]3CCOC[C@@H]3F)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C26H25F3N6O3/c1-35-12-16(10-31-35)24(14-3-4-23(37-2)19(28)7-14)34-25(36)15-8-18(27)17-11-30-26(33-22(17)9-15)32-21-5-6-38-13-20(21)29/h3-4,7-12,20-21,24H,5-6,13H2,1-2H3,(H,34,36)(H,30,32,33)/t20-,21+,24-/m0/s1
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n/an/a 4n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192383
PNG
(US9187462, I-63)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(NCC3COC3)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C25H24F2N6O3/c1-33-11-17(9-30-33)23(15-3-4-22(35-2)20(27)5-15)32-24(34)16-6-19(26)18-10-29-25(31-21(18)7-16)28-8-14-12-36-13-14/h3-7,9-11,14,23H,8,12-13H2,1-2H3,(H,32,34)(H,28,29,31)/t23-/m0/s1
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n/an/a 4n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192398
PNG
(US9187462, II-8)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1ccc2cnc(N[C@@H]3C[C@H](O)C3)nc2c1)c1cnn(C)c1 |r,wU:21.21,23.24,wD:9.10,(10.99,-2.65,;9.66,-3.42,;8.33,-2.65,;8.28,-1.08,;6.94,-.31,;5.61,-1.08,;5.61,-2.62,;6.94,-3.39,;6.94,-4.93,;4.28,-.31,;2.94,-1.08,;1.61,-.31,;1.61,1.23,;.28,-1.08,;.28,-2.62,;-1.06,-3.39,;-2.39,-2.62,;-3.72,-3.39,;-5.06,-2.62,;-5.06,-1.08,;-6.39,-.31,;-7.73,-1.08,;-9.21,-.68,;-9.61,-2.17,;-10.95,-2.94,;-8.12,-2.57,;-3.72,-.31,;-2.39,-1.08,;-1.06,-.31,;4.28,1.23,;3.03,2.13,;3.51,3.6,;5.07,3.63,;5.98,4.88,;5.52,2.13,)|
Show InChI InChI=1S/C25H25FN6O3/c1-32-13-17(12-28-32)23(14-5-6-22(35-2)20(26)7-14)31-24(34)15-3-4-16-11-27-25(30-21(16)8-15)29-18-9-19(33)10-18/h3-8,11-13,18-19,23,33H,9-10H2,1-2H3,(H,31,34)(H,27,29,30)/t18-,19+,23-/m0/s1
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n/an/a 4.20n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192366
PNG
(US9187462, I-46)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1ccc2cnc(N[C@H]3CCO[C@H](CO)C3)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C27H29FN6O4/c1-34-14-19(13-30-34)25(16-5-6-24(37-2)22(28)9-16)33-26(36)17-3-4-18-12-29-27(32-23(18)10-17)31-20-7-8-38-21(11-20)15-35/h3-6,9-10,12-14,20-21,25,35H,7-8,11,15H2,1-2H3,(H,33,36)(H,29,31,32)/t20-,21-,25-/m0/s1
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n/an/a 4.20n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192390
PNG
(BDBM192405 | US9187462, I-70 | US9187462, II-15)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(N[C@@H]3CCOC[C@@H]3F)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C26H25F3N6O3/c1-35-12-16(10-31-35)24(14-3-4-23(37-2)19(28)7-14)34-25(36)15-8-18(27)17-11-30-26(33-22(17)9-15)32-21-5-6-38-13-20(21)29/h3-4,7-12,20-21,24H,5-6,13H2,1-2H3,(H,34,36)(H,30,32,33)/t20-,21+,24-/m0/s1
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n/an/a 4.30n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192422
PNG
(US9187462, II-32)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(N[C@H]3C[C@H](F)C3)nc2c1)c1cnn(OC)c1 |r,wU:22.22,9.10,wD:24.25,(9.26,1.5,;7.93,2.27,;6.59,1.49,;5.21,2.24,;3.88,1.47,;3.88,-.07,;5.21,-.84,;6.55,-.07,;7.88,-.84,;2.55,-.84,;1.21,-.07,;1.21,1.47,;2.55,2.24,;-.12,2.24,;-.12,3.78,;-1.46,4.55,;-1.46,6.09,;-2.79,3.78,;-4.12,4.55,;-5.46,3.78,;-5.46,2.24,;-6.79,1.47,;-6.79,-.07,;-5.7,-1.16,;-6.79,-2.25,;-6.79,-3.79,;-7.88,-1.16,;-4.12,1.47,;-2.79,2.24,;-1.46,1.47,;2.55,-2.38,;1.3,-3.29,;1.78,-4.75,;3.34,-4.79,;4.24,-6.03,;5.78,-5.87,;3.79,-3.29,)|
Show InChI InChI=1S/C25H23F3N6O3/c1-36-22-4-3-13(5-20(22)28)23(15-10-30-34(12-15)37-2)33-24(35)14-6-19(27)18-11-29-25(32-21(18)7-14)31-17-8-16(26)9-17/h3-7,10-12,16-17,23H,8-9H2,1-2H3,(H,33,35)(H,29,31,32)/t16-,17-,23-/m0/s1
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n/an/a 4.5n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192407
PNG
(US9187462, II-17)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1ccc2cnc(Nc3ccnc(C)c3)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C27H24FN7O2/c1-16-10-21(8-9-29-16)32-27-30-13-19-5-4-18(12-23(19)33-27)26(36)34-25(20-14-31-35(2)15-20)17-6-7-24(37-3)22(28)11-17/h4-15,25H,1-3H3,(H,34,36)(H,29,30,32,33)/t25-/m0/s1
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n/an/a 4.80n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192324
PNG
(US9187462, I-4)
Show SMILES Cn1ccc(n1)C(NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)c1ccc(Cl)c(F)c1
Show InChI InChI=1S/C25H24ClFN6O2/c1-33-9-6-21(32-33)23(15-4-5-19(26)20(27)12-15)31-24(34)16-2-3-17-14-28-25(30-22(17)13-16)29-18-7-10-35-11-8-18/h2-6,9,12-14,18,23H,7-8,10-11H2,1H3,(H,31,34)(H,28,29,30)
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n/an/a 5n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192326
PNG
(US9187462, I-6)
Show SMILES CC(CO)Nc1ncc2ccc(cc2n1)C(=O)NC(c1ccn(C)n1)c1ccc(Cl)c(F)c1
Show InChI InChI=1S/C23H22ClFN6O2/c1-13(12-32)27-23-26-11-16-4-3-15(10-20(16)28-23)22(33)29-21(19-7-8-31(2)30-19)14-5-6-17(24)18(25)9-14/h3-11,13,21,32H,12H2,1-2H3,(H,29,33)(H,26,27,28)
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n/an/a 5n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192387
PNG
(US9187462, I-67)
Show SMILES COc1ccc(cc1F)C(NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)c1cnn(CCO)c1
Show InChI InChI=1S/C27H29FN6O4/c1-37-24-5-4-17(12-22(24)28)25(20-15-30-34(16-20)8-9-35)33-26(36)18-2-3-19-14-29-27(32-23(19)13-18)31-21-6-10-38-11-7-21/h2-5,12-16,21,25,35H,6-11H2,1H3,(H,33,36)(H,29,31,32)
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n/an/a 5n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192431
PNG
(US9187462, II-41)
Show SMILES Cn1cc(cn1)[C@@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)c1ccc(c(F)c1)C(F)(F)F |r|
Show InChI InChI=1S/C26H24F4N6O2/c1-36-14-18(13-32-36)23(15-4-5-20(21(27)10-15)26(28,29)30)35-24(37)16-2-3-17-12-31-25(34-22(17)11-16)33-19-6-8-38-9-7-19/h2-5,10-14,19,23H,6-9H2,1H3,(H,35,37)(H,31,33,34)/t23-/m0/s1
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n/an/a 5.20n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192330
PNG
(US9187462, I-10)
Show SMILES Fc1ccc(cc1Cl)[C@@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)[C@H]1CCNC1 |r|
Show InChI InChI=1S/C25H27ClFN5O2/c26-20-11-15(3-4-21(20)27)23(18-5-8-28-13-18)32-24(33)16-1-2-17-14-29-25(31-22(17)12-16)30-19-6-9-34-10-7-19/h1-4,11-12,14,18-19,23,28H,5-10,13H2,(H,32,33)(H,29,30,31)/t18-,23+/m0/s1
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n/an/a 5.40n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192416
PNG
(US9187462, II-26)
Show SMILES C[C@@H](CO)Nc1ncc2c(F)cc(cc2n1)C(=O)N[C@H](c1cnn(C)c1)c1cccc(F)c1 |r|
Show InChI InChI=1S/C23H22F2N6O2/c1-13(12-32)28-23-26-10-18-19(25)7-15(8-20(18)29-23)22(33)30-21(16-9-27-31(2)11-16)14-4-3-5-17(24)6-14/h3-11,13,21,32H,12H2,1-2H3,(H,30,33)(H,26,28,29)/t13-,21-/m0/s1
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n/an/a 5.60n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192397
PNG
(US9187462, II-7)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(NC3CC(F)(F)C3)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C25H22F4N6O2/c1-35-12-15(10-31-35)22(13-3-4-21(37-2)19(27)5-13)34-23(36)14-6-18(26)17-11-30-24(33-20(17)7-14)32-16-8-25(28,29)9-16/h3-7,10-12,16,22H,8-9H2,1-2H3,(H,34,36)(H,30,32,33)/t22-/m0/s1
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n/an/a 5.60n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192380
PNG
(US9187462, I-60)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(NCC3CC3)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C25H24F2N6O2/c1-33-13-17(11-30-33)23(15-5-6-22(35-2)20(27)7-15)32-24(34)16-8-19(26)18-12-29-25(31-21(18)9-16)28-10-14-3-4-14/h5-9,11-14,23H,3-4,10H2,1-2H3,(H,32,34)(H,28,29,31)/t23-/m0/s1
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n/an/a 6n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192384
PNG
(US9187462, I-64)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(NC3(C)COC3)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C25H24F2N6O3/c1-25(12-36-13-25)32-24-28-10-17-18(26)7-15(8-20(17)30-24)23(34)31-22(16-9-29-33(2)11-16)14-4-5-21(35-3)19(27)6-14/h4-11,22H,12-13H2,1-3H3,(H,31,34)(H,28,30,32)/t22-/m0/s1
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n/an/a 6n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192391
PNG
(US9187462, II-1 | US9187462, II-2)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(NC(C)C(F)(F)F)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C24H21F5N6O2/c1-12(24(27,28)29)32-23-30-10-16-17(25)7-14(8-19(16)33-23)22(36)34-21(15-9-31-35(2)11-15)13-4-5-20(37-3)18(26)6-13/h4-12,21H,1-3H3,(H,34,36)(H,30,32,33)/t12?,21-/m0/s1
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n/an/a 6.20n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192331
PNG
(US9187462, I-11)
Show SMILES Fc1ccc(cc1Cl)[C@@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)[C@@H]1CCNC1 |r|
Show InChI InChI=1S/C25H27ClFN5O2/c26-20-11-15(3-4-21(20)27)23(18-5-8-28-13-18)32-24(33)16-1-2-17-14-29-25(31-22(17)12-16)30-19-6-9-34-10-7-19/h1-4,11-12,14,18-19,23,28H,5-10,13H2,(H,32,33)(H,29,30,31)/t18-,23-/m1/s1
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n/an/a 6.40n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192328
PNG
(US9187462, I-8)
Show SMILES Fc1ccc(cc1Cl)[C@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)[C@@H]1CCNC1 |r|
Show InChI InChI=1S/C25H27ClFN5O2/c26-20-11-15(3-4-21(20)27)23(18-5-8-28-13-18)32-24(33)16-1-2-17-14-29-25(31-22(17)12-16)30-19-6-9-34-10-7-19/h1-4,11-12,14,18-19,23,28H,5-10,13H2,(H,32,33)(H,29,30,31)/t18-,23+/m1/s1
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n/an/a 6.70n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192329
PNG
(US9187462, I-9)
Show SMILES Fc1ccc(cc1Cl)[C@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)[C@H]1CCNC1 |r|
Show InChI InChI=1S/C25H27ClFN5O2/c26-20-11-15(3-4-21(20)27)23(18-5-8-28-13-18)32-24(33)16-1-2-17-14-29-25(31-22(17)12-16)30-19-6-9-34-10-7-19/h1-4,11-12,14,18-19,23,28H,5-10,13H2,(H,32,33)(H,29,30,31)/t18-,23-/m0/s1
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n/an/a 6.70n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192409
PNG
(US9187462, II-19)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(Nc3cn(C)nc3C)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C26H24F2N8O2/c1-14-22(13-36(3)34-14)32-26-29-11-18-19(27)8-16(9-21(18)31-26)25(37)33-24(17-10-30-35(2)12-17)15-5-6-23(38-4)20(28)7-15/h5-13,24H,1-4H3,(H,33,37)(H,29,31,32)/t24-/m0/s1
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n/an/a 6.80n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192373
PNG
(US9187462, I-53)
Show SMILES COc1ccc(cc1F)C(NC(=O)c1cc(F)c2cnc(NC3CCOCC3)nc2c1)c1cnn(C)n1
Show InChI InChI=1S/C25H25F2N7O3/c1-34-29-13-21(33-34)23(14-3-4-22(36-2)19(27)9-14)32-24(35)15-10-18(26)17-12-28-25(31-20(17)11-15)30-16-5-7-37-8-6-16/h3-4,9-13,16,23H,5-8H2,1-2H3,(H,32,35)(H,28,30,31)
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n/an/a 6.80n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192435
PNG
(US9187462, II-45)
Show SMILES Fc1cc(ccc1OC(F)(F)F)[C@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)C1CNCCO1 |r|
Show InChI InChI=1S/C26H27F4N5O4/c27-19-11-15(3-4-21(19)39-26(28,29)30)23(22-14-31-7-10-38-22)35-24(36)16-1-2-17-13-32-25(34-20(17)12-16)33-18-5-8-37-9-6-18/h1-4,11-13,18,22-23,31H,5-10,14H2,(H,35,36)(H,32,33,34)/t22?,23-/m0/s1
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n/an/a 6.90n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192412
PNG
(US9187462, II-22)
Show SMILES COc1ccc(cc1)[C@H](NC(=O)c1cc(F)c2cnc(NC3CCOCC3)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C26H27FN6O3/c1-33-15-18(13-29-33)24(16-3-5-20(35-2)6-4-16)32-25(34)17-11-22(27)21-14-28-26(31-23(21)12-17)30-19-7-9-36-10-8-19/h3-6,11-15,19,24H,7-10H2,1-2H3,(H,32,34)(H,28,30,31)/t24-/m0/s1
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n/an/a 7n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192362
PNG
(US9187462, I-42)
Show SMILES Cn1cc(cn1)[C@@H](NC(=O)c1ccc2cnc(N[C@H]3CCO[C@H](CO)C3)nc2c1)c1ccc(Cl)c(F)c1 |r|
Show InChI InChI=1S/C26H26ClFN6O3/c1-34-13-18(12-30-34)24(15-4-5-21(27)22(28)8-15)33-25(36)16-2-3-17-11-29-26(32-23(17)9-16)31-19-6-7-37-20(10-19)14-35/h2-5,8-9,11-13,19-20,24,35H,6-7,10,14H2,1H3,(H,33,36)(H,29,31,32)/t19-,20-,24-/m0/s1
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n/an/a 7.20n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192360
PNG
(US9187462, I-40)
Show SMILES C[C@H](Nc1ncc2ccc(cc2n1)C(=O)N[C@H]([C@@H]1CCCN1)c1ccc(Cl)c(F)c1)C(F)(F)F |r|
Show InChI InChI=1S/C23H22ClF4N5O/c1-12(23(26,27)28)31-22-30-11-15-5-4-14(10-19(15)32-22)21(34)33-20(18-3-2-8-29-18)13-6-7-16(24)17(25)9-13/h4-7,9-12,18,20,29H,2-3,8H2,1H3,(H,33,34)(H,30,31,32)/t12-,18-,20-/m0/s1
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n/an/a 7.30n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192344
PNG
(US9187462, I-24)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)[C@H]1CCCN1 |r|
Show InChI InChI=1S/C26H30FN5O3/c1-34-23-7-6-16(13-20(23)27)24(21-3-2-10-28-21)32-25(33)17-4-5-18-15-29-26(31-22(18)14-17)30-19-8-11-35-12-9-19/h4-7,13-15,19,21,24,28H,2-3,8-12H2,1H3,(H,32,33)(H,29,30,31)/t21-,24+/m1/s1
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n/an/a 8.20n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192444
PNG
(US9187462, II-54)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(Nc3ccnn3C)nc2c1)c1nccn1C |r|
Show InChI InChI=1S/C25H22F2N8O2/c1-34-9-8-28-23(34)22(14-4-5-20(37-3)18(27)10-14)33-24(36)15-11-17(26)16-13-29-25(31-19(16)12-15)32-21-6-7-30-35(21)2/h4-13,22H,1-3H3,(H,33,36)(H,29,31,32)/t22-/m0/s1
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n/an/a 8.5n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192345
PNG
(US9187462, I-25)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(NC3CCOCC3)nc2c1)[C@H]1CCCN1 |r|
Show InChI InChI=1S/C26H29F2N5O3/c1-35-23-5-4-15(11-20(23)28)24(21-3-2-8-29-21)33-25(34)16-12-19(27)18-14-30-26(32-22(18)13-16)31-17-6-9-36-10-7-17/h4-5,11-14,17,21,24,29H,2-3,6-10H2,1H3,(H,33,34)(H,30,31,32)/t21-,24+/m1/s1
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n/an/a 9n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192410
PNG
(US9187462, II-20)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(N[C@@H]3CC[C@H](O)CC3)nc2c1)c1cnn(C)c1 |r,wU:22.22,9.10,25.26,(9.38,1.49,;8.05,2.26,;6.72,1.49,;5.33,2.24,;4,1.47,;4,-.07,;5.33,-.84,;6.67,-.07,;8,-.84,;2.67,-.84,;1.33,-.07,;1.33,1.47,;2.67,2.24,;,2.24,;,3.78,;-1.33,4.55,;-1.33,6.09,;-2.67,3.78,;-4,4.55,;-5.33,3.78,;-5.33,2.24,;-6.67,1.47,;-6.67,-.07,;-8,-.84,;-8,-2.38,;-6.67,-3.15,;-6.67,-4.69,;-5.33,-2.38,;-5.33,-.84,;-4,1.47,;-2.67,2.24,;-1.33,1.47,;2.67,-2.38,;3.91,-3.29,;3.44,-4.75,;1.87,-4.79,;.97,-6.03,;1.42,-3.29,)|
Show InChI InChI=1S/C27H28F2N6O3/c1-35-14-17(12-31-35)25(15-3-8-24(38-2)22(29)9-15)34-26(37)16-10-21(28)20-13-30-27(33-23(20)11-16)32-18-4-6-19(36)7-5-18/h3,8-14,18-19,25,36H,4-7H2,1-2H3,(H,34,37)(H,30,32,33)/t18-,19+,25-/m0/s1
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n/an/a 9.70n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192413
PNG
(US9187462, II-23)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(Nc3ccnn3C)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C25H22F2N8O2/c1-34-13-16(11-30-34)23(14-4-5-21(37-3)19(27)8-14)33-24(36)15-9-18(26)17-12-28-25(31-20(17)10-15)32-22-6-7-29-35(22)2/h4-13,23H,1-3H3,(H,33,36)(H,28,31,32)/t23-/m0/s1
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n/an/a 10.8n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192433
PNG
(US9187462, II-43)
Show SMILES Cn1cc(cn1)C(NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)c1ccc(OC(F)F)cc1
Show InChI InChI=1S/C26H26F2N6O3/c1-34-15-19(14-30-34)23(16-4-6-21(7-5-16)37-25(27)28)33-24(35)17-2-3-18-13-29-26(32-22(18)12-17)31-20-8-10-36-11-9-20/h2-7,12-15,20,23,25H,8-11H2,1H3,(H,33,35)(H,29,31,32)
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n/an/a 12.1n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192338
PNG
(US9187462, I-18)
Show SMILES CCn1ccc(n1)[C@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)c1ccc(Cl)c(F)c1 |r|
Show InChI InChI=1S/C26H26ClFN6O2/c1-2-34-10-7-22(33-34)24(16-5-6-20(27)21(28)13-16)32-25(35)17-3-4-18-15-29-26(31-23(18)14-17)30-19-8-11-36-12-9-19/h3-7,10,13-15,19,24H,2,8-9,11-12H2,1H3,(H,32,35)(H,29,30,31)/t24-/m1/s1
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n/an/a 12.8n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192395
PNG
(US9187462, II-5)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1ccc2cnc(NC3CSC3)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C24H23FN6O2S/c1-31-11-17(10-27-31)22(14-5-6-21(33-2)19(25)7-14)30-23(32)15-3-4-16-9-26-24(29-20(16)8-15)28-18-12-34-13-18/h3-11,18,22H,12-13H2,1-2H3,(H,30,32)(H,26,28,29)/t22-/m0/s1
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n/an/a 13n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192391
PNG
(US9187462, II-1 | US9187462, II-2)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(NC(C)C(F)(F)F)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C24H21F5N6O2/c1-12(24(27,28)29)32-23-30-10-16-17(25)7-14(8-19(16)33-23)22(36)34-21(15-9-31-35(2)11-15)13-4-5-20(37-3)18(26)6-13/h4-12,21H,1-3H3,(H,34,36)(H,30,32,33)/t12?,21-/m0/s1
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n/an/a 13.6n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192400
PNG
(US9187462, II-10)
Show SMILES COC1CC(C1)Nc1ncc2ccc(cc2n1)C(=O)N[C@H](c1cnn(C)c1)c1ccc(OC)c(F)c1 |r,wD:20.22,(-12.28,-2.17,;-10.95,-2.94,;-9.61,-2.17,;-9.21,-.68,;-7.73,-1.08,;-8.12,-2.57,;-6.39,-.31,;-5.06,-1.08,;-5.06,-2.62,;-3.72,-3.39,;-2.39,-2.62,;-1.06,-3.39,;.28,-2.62,;.28,-1.08,;-1.06,-.31,;-2.39,-1.08,;-3.72,-.31,;1.61,-.31,;1.61,1.23,;2.94,-1.08,;4.28,-.31,;4.28,1.23,;3.03,2.13,;3.51,3.6,;5.07,3.63,;5.98,4.88,;5.52,2.13,;5.61,-1.08,;6.94,-.31,;8.28,-1.08,;8.33,-2.65,;9.66,-3.42,;10.99,-2.65,;6.94,-3.39,;6.94,-4.93,;5.61,-2.62,)|
Show InChI InChI=1S/C26H27FN6O3/c1-33-14-18(13-29-33)24(15-6-7-23(36-3)21(27)8-15)32-25(34)16-4-5-17-12-28-26(31-22(17)9-16)30-19-10-20(11-19)35-2/h4-9,12-14,19-20,24H,10-11H2,1-3H3,(H,32,34)(H,28,30,31)/t19?,20?,24-/m0/s1
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n/an/a 13.8n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192401
PNG
(US9187462, II-11)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(NCCC#N)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C24H21F2N7O2/c1-33-13-16(11-30-33)22(14-4-5-21(35-2)19(26)8-14)32-23(34)15-9-18(25)17-12-29-24(28-7-3-6-27)31-20(17)10-15/h4-5,8-13,22H,3,7H2,1-2H3,(H,32,34)(H,28,29,31)/t22-/m0/s1
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n/an/a 13.9n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192414
PNG
(US9187462, II-24)
Show SMILES Cc1cc(Nc2ncc3ccc(cc3n2)C(=O)N[C@H](c2cnn(C)c2)c2ccc(Cl)c(F)c2)n(C)n1 |r|
Show InChI InChI=1S/C25H22ClFN8O/c1-14-8-22(35(3)33-14)31-25-28-11-17-5-4-16(10-21(17)30-25)24(36)32-23(18-12-29-34(2)13-18)15-6-7-19(26)20(27)9-15/h4-13,23H,1-3H3,(H,32,36)(H,28,30,31)/t23-/m0/s1
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n/an/a 14.6n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192379
PNG
(US9187462, I-59)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(NCCCF)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C24H23F3N6O2/c1-33-13-16(11-30-33)22(14-4-5-21(35-2)19(27)8-14)32-23(34)15-9-18(26)17-12-29-24(28-7-3-6-25)31-20(17)10-15/h4-5,8-13,22H,3,6-7H2,1-2H3,(H,32,34)(H,28,29,31)/t22-/m0/s1
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n/an/a 15n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192421
PNG
(US9187462, II-31)
Show SMILES COCC(C)Nc1ncc2ccc(cc2n1)C(=O)N[C@H](c1cnn(C)c1)c1ccc(OC)c(F)c1 |r|
Show InChI InChI=1S/C25H27FN6O3/c1-15(14-34-3)29-25-27-11-18-6-5-17(10-21(18)30-25)24(33)31-23(19-12-28-32(2)13-19)16-7-8-22(35-4)20(26)9-16/h5-13,15,23H,14H2,1-4H3,(H,31,33)(H,27,29,30)/t15?,23-/m0/s1
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n/an/a 15n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192394
PNG
(US9187462, II-4)
Show SMILES COc1ccc(cc1F)[C@@H](NC(=O)c1cc(F)c2cnc(NC3CCOCC3)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C26H26F2N6O3/c1-34-14-17(12-30-34)24(15-3-4-23(36-2)21(28)9-15)33-25(35)16-10-20(27)19-13-29-26(32-22(19)11-16)31-18-5-7-37-8-6-18/h3-4,9-14,18,24H,5-8H2,1-2H3,(H,33,35)(H,29,31,32)/t24-/m1/s1
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n/an/a 15.7n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192347
PNG
(US9187462, I-27)
Show SMILES Cn1cc(cn1)[C@@H](NC(=O)c1ccc2cnc(N[C@@H]3CCOC[C@@H]3F)nc2c1)c1ccc(Cl)c(F)c1 |r|
Show InChI InChI=1S/C25H23ClF2N6O2/c1-34-12-17(11-30-34)23(14-4-5-18(26)19(27)8-14)33-24(35)15-2-3-16-10-29-25(32-22(16)9-15)31-21-6-7-36-13-20(21)28/h2-5,8-12,20-21,23H,6-7,13H2,1H3,(H,33,35)(H,29,31,32)/t20-,21+,23-/m0/s1
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n/an/a 15.8n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192378
PNG
(US9187462, I-58)
Show SMILES COCCNc1ncc2c(F)cc(cc2n1)C(=O)N[C@H](c1cnn(C)c1)c1ccc(OC)c(F)c1 |r|
Show InChI InChI=1S/C24H24F2N6O3/c1-32-13-16(11-29-32)22(14-4-5-21(35-3)19(26)8-14)31-23(33)15-9-18(25)17-12-28-24(27-6-7-34-2)30-20(17)10-15/h4-5,8-13,22H,6-7H2,1-3H3,(H,31,33)(H,27,28,30)/t22-/m0/s1
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n/an/a 20n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192365
PNG
(BDBM192434 | US9187462, I-45)
Show SMILES Cn1cc(cn1)[C@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)c1ccc(C#N)c(F)c1 |r|
Show InChI InChI=1S/C26H24FN7O2/c1-34-15-20(14-30-34)24(16-2-4-18(12-28)22(27)10-16)33-25(35)17-3-5-19-13-29-26(32-23(19)11-17)31-21-6-8-36-9-7-21/h2-5,10-11,13-15,21,24H,6-9H2,1H3,(H,33,35)(H,29,31,32)/t24-/m1/s1
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n/an/a 22n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192377
PNG
(US9187462, I-57)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1ccc2cnc(N[C@H]3CCO[C@H](COC(C)=O)C3)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C29H31FN6O5/c1-17(37)41-16-23-12-22(8-9-40-23)33-29-31-13-20-5-4-19(11-25(20)34-29)28(38)35-27(21-14-32-36(2)15-21)18-6-7-26(39-3)24(30)10-18/h4-7,10-11,13-15,22-23,27H,8-9,12,16H2,1-3H3,(H,35,38)(H,31,33,34)/t22-,23-,27-/m0/s1
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n/an/a 24n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192370
PNG
(US9187462, I-50)
Show SMILES Cn1cc(cn1)[C@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)c1ccc(C#N)c(Cl)c1 |r|
Show InChI InChI=1S/C26H24ClN7O2/c1-34-15-20(14-30-34)24(16-2-4-18(12-28)22(27)10-16)33-25(35)17-3-5-19-13-29-26(32-23(19)11-17)31-21-6-8-36-9-7-21/h2-5,10-11,13-15,21,24H,6-9H2,1H3,(H,33,35)(H,29,31,32)/t24-/m1/s1
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n/an/a 25n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192430
PNG
(US9187462, II-40)
Show SMILES Cn1nccc1[C@@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)c1ccc(C#N)c(Cl)c1 |r|
Show InChI InChI=1S/C26H24ClN7O2/c1-34-23(6-9-30-34)24(16-2-4-18(14-28)21(27)12-16)33-25(35)17-3-5-19-15-29-26(32-22(19)13-17)31-20-7-10-36-11-8-20/h2-6,9,12-13,15,20,24H,7-8,10-11H2,1H3,(H,33,35)(H,29,31,32)/t24-/m0/s1
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n/an/a 26n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192374
PNG
(US9187462, I-54)
Show SMILES COc1ccc(cc1F)[C@@H](NC(=O)c1cc(F)c2cnc(NC3CCOCC3)nc2c1)c1cnn(C)n1 |r|
Show InChI InChI=1S/C25H25F2N7O3/c1-34-29-13-21(33-34)23(14-3-4-22(36-2)19(27)9-14)32-24(35)15-10-18(26)17-12-28-25(31-20(17)11-15)30-16-5-7-37-8-6-16/h3-4,9-13,16,23H,5-8H2,1-2H3,(H,32,35)(H,28,30,31)/t23-/m1/s1
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n/an/a 31n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192432
PNG
(US9187462, II-42)
Show SMILES Cn1nccc1Nc1ncc2ccc(cc2n1)C(=C)N[C@@H](c1ccc(Cl)c(F)c1)[C@]1(F)CCNC1 |r|
Show InChI InChI=1S/C25H24ClF2N7/c1-15(32-23(25(28)8-10-29-14-25)17-5-6-19(26)20(27)11-17)16-3-4-18-13-30-24(33-21(18)12-16)34-22-7-9-31-35(22)2/h3-7,9,11-13,23,29,32H,1,8,10,14H2,2H3,(H,30,33,34)/t23-,25-/m0/s1
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n/an/a 34.6n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192333
PNG
(US9187462, I-13)
Show SMILES Cn1cc(cn1)[C@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)c1ccc(Cl)c(F)c1 |r|
Show InChI InChI=1S/C25H24ClFN6O2/c1-33-14-18(13-29-33)23(15-4-5-20(26)21(27)10-15)32-24(34)16-2-3-17-12-28-25(31-22(17)11-16)30-19-6-8-35-9-7-19/h2-5,10-14,19,23H,6-9H2,1H3,(H,32,34)(H,28,30,31)/t23-/m1/s1
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n/an/a 38.8n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192393
PNG
(US9187462, II-3)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1ccc2cnc(NC3CS(=O)(=O)C3)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C24H23FN6O4S/c1-31-11-17(10-27-31)22(14-5-6-21(35-2)19(25)7-14)30-23(32)15-3-4-16-9-26-24(29-20(16)8-15)28-18-12-36(33,34)13-18/h3-11,18,22H,12-13H2,1-2H3,(H,30,32)(H,26,28,29)/t22-/m0/s1
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n/an/a 52.8n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192334
PNG
(US9187462, I-14)
Show SMILES C[C@@H](CO)Nc1ncc2ccc(cc2n1)C(=O)N[C@@H](c1cnn(C)c1)c1ccc(Cl)c(F)c1 |r|
Show InChI InChI=1S/C23H22ClFN6O2/c1-13(12-32)28-23-26-9-16-4-3-15(8-20(16)29-23)22(33)30-21(17-10-27-31(2)11-17)14-5-6-18(24)19(25)7-14/h3-11,13,21,32H,12H2,1-2H3,(H,30,33)(H,26,28,29)/t13-,21+/m0/s1
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n/an/a 56.8n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192440
PNG
(US9187462, II-50)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(NC3CCOCC3)nc2c1)c1ncc[nH]1 |r|
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n/an/a 59.1n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192425
PNG
(US9187462, II-35)
Show SMILES COc1ccnc(c1)C(NC(=O)c1cc(F)c2cnc(NC3CCOCC3)nc2c1)c1cnn(C)c1
Show InChI InChI=1S/C25H26FN7O3/c1-33-14-16(12-29-33)23(22-11-18(35-2)3-6-27-22)32-24(34)15-9-20(26)19-13-28-25(31-21(19)10-15)30-17-4-7-36-8-5-17/h3,6,9-14,17,23H,4-5,7-8H2,1-2H3,(H,32,34)(H,28,30,31)
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n/an/a 61n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192358
PNG
(US9187462, I-38)
Show SMILES Fc1ccc(cc1Cl)[C@@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)[C@]1(F)CCNC1 |r|
Show InChI InChI=1S/C25H26ClF2N5O2/c26-19-11-15(3-4-20(19)27)22(25(28)7-8-29-14-25)33-23(34)16-1-2-17-13-30-24(32-21(17)12-16)31-18-5-9-35-10-6-18/h1-4,11-13,18,22,29H,5-10,14H2,(H,33,34)(H,30,31,32)/t22-,25+/m1/s1
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n/an/a 65.4n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192341
PNG
(US9187462, I-21)
Show SMILES Cn1ccc(n1)[C@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)c1ccc(Cl)c(F)c1 |r|
Show InChI InChI=1S/C25H24ClFN6O2/c1-33-9-6-21(32-33)23(15-4-5-19(26)20(27)12-15)31-24(34)16-2-3-17-14-28-25(30-22(17)13-16)29-18-7-10-35-11-8-18/h2-6,9,12-14,18,23H,7-8,10-11H2,1H3,(H,31,34)(H,28,29,30)/t23-/m1/s1
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n/an/a 69n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192357
PNG
(US9187462, I-37)
Show SMILES Fc1ccc(cc1Cl)[C@@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)[C@@]1(F)CCNC1 |r|
Show InChI InChI=1S/C25H26ClF2N5O2/c26-19-11-15(3-4-20(19)27)22(25(28)7-8-29-14-25)33-23(34)16-1-2-17-13-30-24(32-21(17)12-16)31-18-5-9-35-10-6-18/h1-4,11-13,18,22,29H,5-10,14H2,(H,33,34)(H,30,31,32)/t22-,25-/m1/s1
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n/an/a 73.6n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192439
PNG
(US9187462, II-49)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(NC3CCOCC3)nc2c1)c1cn(C)cn1 |r|
Show InChI InChI=1S/C26H26F2N6O3/c1-34-13-22(30-14-34)24(15-3-4-23(36-2)20(28)9-15)33-25(35)16-10-19(27)18-12-29-26(32-21(18)11-16)31-17-5-7-37-8-6-17/h3-4,9-14,17,24H,5-8H2,1-2H3,(H,33,35)(H,29,31,32)/t24-/m0/s1
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n/an/a 85.5n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192369
PNG
(US9187462, I-49)
Show SMILES COc1ccc(cc1C#N)[C@@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C27H27N7O3/c1-34-16-21(15-30-34)25(17-5-6-24(36-2)20(11-17)13-28)33-26(35)18-3-4-19-14-29-27(32-23(19)12-18)31-22-7-9-37-10-8-22/h3-6,11-12,14-16,22,25H,7-10H2,1-2H3,(H,33,35)(H,29,31,32)/t25-/m1/s1
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n/an/a 141n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192429
PNG
(US9187462, II-39)
Show SMILES Cn1nccc1[C@@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)c1ccc(Cl)c(F)c1 |r|
Show InChI InChI=1S/C25H24ClFN6O2/c1-33-22(6-9-29-33)23(15-4-5-19(26)20(27)12-15)32-24(34)16-2-3-17-14-28-25(31-21(17)13-16)30-18-7-10-35-11-8-18/h2-6,9,12-14,18,23H,7-8,10-11H2,1H3,(H,32,34)(H,28,30,31)/t23-/m0/s1
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n/an/a 151n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192404
PNG
(US9187462, II-14)
Show SMILES COc1ccc(nc1)[C@H](NC(=O)c1cc(F)c2cnc(NC3CCOCC3)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C25H26FN7O3/c1-33-14-16(11-29-33)23(21-4-3-18(35-2)12-27-21)32-24(34)15-9-20(26)19-13-28-25(31-22(19)10-15)30-17-5-7-36-8-6-17/h3-4,9-14,17,23H,5-8H2,1-2H3,(H,32,34)(H,28,30,31)/t23-/m1/s1
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n/an/a 153n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192396
PNG
(US9187462, II-6)
Show SMILES Cn1cc(cn1)[C@@H](NC(=O)c1cc(F)c2cnc(NC3CCOCC3)nc2c1)c1ccc(F)c(Cl)c1 |r|
Show InChI InChI=1S/C25H23ClF2N6O2/c1-34-13-16(11-30-34)23(14-2-3-20(27)19(26)8-14)33-24(35)15-9-21(28)18-12-29-25(32-22(18)10-15)31-17-4-6-36-7-5-17/h2-3,8-13,17,23H,4-7H2,1H3,(H,33,35)(H,29,31,32)/t23-/m0/s1
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n/an/a 157n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192441
PNG
(US9187462, II-51)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1cc(F)c2cnc(NC3CCOCC3)nc2c1)c1c[nH]c(C)n1 |r|
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n/an/a 164n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192365
PNG
(BDBM192434 | US9187462, I-45)
Show SMILES Cn1cc(cn1)[C@H](NC(=O)c1ccc2cnc(NC3CCOCC3)nc2c1)c1ccc(C#N)c(F)c1 |r|
Show InChI InChI=1S/C26H24FN7O2/c1-34-15-20(14-30-34)24(16-2-4-18(12-28)22(27)10-16)33-25(35)17-3-5-19-13-29-26(32-23(19)11-17)31-21-6-8-36-9-7-21/h2-5,10-11,13-15,21,24H,6-9H2,1H3,(H,33,35)(H,29,31,32)/t24-/m1/s1
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n/an/a 216n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192417
PNG
(US9187462, II-27)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1ccc2cnc(Nc3cn(C)nc3C)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C26H25FN8O2/c1-15-22(14-35(3)33-15)31-26-28-11-18-6-5-17(10-21(18)30-26)25(36)32-24(19-12-29-34(2)13-19)16-7-8-23(37-4)20(27)9-16/h5-14,24H,1-4H3,(H,32,36)(H,28,30,31)/t24-/m0/s1
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n/an/a 960n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192424
PNG
(US9187462, II-34)
Show SMILES COc1ccc(cc1F)C(NC(=O)c1cc(F)c2cnc(NC3CC4CC3CO4)nc2c1)c1cnn(C)c1
Show InChI InChI=1S/C27H26F2N6O3/c1-35-12-17(10-31-35)25(14-3-4-24(37-2)21(29)6-14)34-26(36)15-7-20(28)19-11-30-27(33-23(19)8-15)32-22-9-18-5-16(22)13-38-18/h3-4,6-8,10-12,16,18,22,25H,5,9,13H2,1-2H3,(H,34,36)(H,30,32,33)
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n/an/a 1.00E+3n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 1 [8-360]


(Homo sapiens (Human))		BDBM192420
PNG
(US9187462, II-30)
Show SMILES COc1ccc(cc1F)[C@H](NC(=O)c1ccc2cnc(N[C@H]3C[C@H]4C[C@@H]3CO4)nc2c1)c1cnn(C)c1 |r|
Show InChI InChI=1S/C27H27FN6O3/c1-34-13-19(12-30-34)25(15-5-6-24(36-2)21(28)8-15)33-26(35)16-3-4-17-11-29-27(31-22(17)9-16)32-23-10-20-7-18(23)14-37-20/h3-6,8-9,11-13,18,20,23,25H,7,10,14H2,1-2H3,(H,33,35)(H,29,31,32)/t18-,20-,23+,25+/m1/s1
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n/an/a 1.00E+3n/an/an/an/a7.3n/a



Array BioPharma Inc.; Genentech, Inc.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an N-terminal 6-His fusion pro...

US Patent US9187462 (2015)


BindingDB Entry DOI: 10.7270/Q21G0K2P
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%