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Compile Data Set for Download or QSAR

Found 201 hits of ph data with Target = 'Serine/threonine-protein kinase mTOR'   
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
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM21026
PNG
((2R,3S,6Z,14S,15S,17R)-6-[(diethylamino)methyliden...)
Show SMILES CCN(CC)C=C1C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]2(C)[C@@H](COC)OC1=O
Show InChI InChI=1S/C27H37NO8/c1-7-28(8-2)12-15-21-24(32)23(31)20-16-9-10-18(30)26(16,4)11-17(35-14(3)29)22(20)27(21,5)19(13-34-6)36-25(15)33/h12,16-19,21,30H,7-11,13H2,1-6H3/t16?,17-,18+,19-,21?,26+,27+/m1/s1
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n/an/a 1.40E+4n/an/an/an/a7.430



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 51: 1319-23 (2008)


Article DOI: 10.1021/jm7012858
BindingDB Entry DOI: 10.7270/Q2NP22QD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35616
PNG
(pyrazolo pyrimidine, 5v)
Show SMILES O=C(N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc2[nH]ccc2c1)N1CCOCC1)c1cccnc1
Show InChI InChI=1S/C28H28N8O2/c37-28(21-2-1-8-29-17-21)35-10-6-22(7-11-35)36-27-23(18-31-36)26(34-12-14-38-15-13-34)32-25(33-27)20-3-4-24-19(16-20)5-9-30-24/h1-5,8-9,16-18,22,30H,6-7,10-15H2
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n/an/a 4n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 7081-9 (2009)


Article DOI: 10.1021/jm9012642
BindingDB Entry DOI: 10.7270/Q2NS0S73
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM21028
PNG
((2R,3S,6Z,14S,15S,17R)-6-[(ethylamino)methylidene]...)
Show SMILES CCNC=C1C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]2(C)[C@@H](COC)OC1=O
Show InChI InChI=1S/C25H33NO8/c1-6-26-10-13-19-22(30)21(29)18-14-7-8-16(28)24(14,3)9-15(33-12(2)27)20(18)25(19,4)17(11-32-5)34-23(13)31/h10,14-17,19,26,28H,6-9,11H2,1-5H3/t14?,15-,16+,17-,19?,24+,25+/m1/s1
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n/an/a>2.00E+4n/an/an/an/a7.430



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 51: 1319-23 (2008)


Article DOI: 10.1021/jm7012858
BindingDB Entry DOI: 10.7270/Q2NP22QD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM21029
PNG
((2R,3S,6Z,14S,15S,17R)-6-{[tert-butyl(2-hydroxyeth...)
Show SMILES COC[C@H]1OC(=O)C(=CN(CCO)C(C)(C)C)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C
Show InChI InChI=1S/C29H41NO9/c1-15(32)38-18-12-28(5)17(8-9-19(28)33)21-23(18)29(6)20(14-37-7)39-26(36)16(22(29)25(35)24(21)34)13-30(10-11-31)27(2,3)4/h13,17-20,22,31,33H,8-12,14H2,1-7H3/t17?,18-,19+,20-,22?,28+,29+/m1/s1
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n/an/a 2.86E+4n/an/an/an/a7.430



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 51: 1319-23 (2008)


Article DOI: 10.1021/jm7012858
BindingDB Entry DOI: 10.7270/Q2NP22QD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM21030
PNG
((2R,3S,6Z,14S,15S,17R)-6-{[tert-butyl(methyl)amino...)
Show SMILES COC[C@H]1OC(=O)C(=CN(C)C(C)(C)C)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C
Show InChI InChI=1S/C28H39NO8/c1-14(30)36-17-11-27(5)16(9-10-18(27)31)20-22(17)28(6)19(13-35-8)37-25(34)15(12-29(7)26(2,3)4)21(28)24(33)23(20)32/h12,16-19,21,31H,9-11,13H2,1-8H3/t16?,17-,18+,19-,21?,27+,28+/m1/s1
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n/an/a 6.50E+3n/an/an/an/a7.430



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 51: 1319-23 (2008)


Article DOI: 10.1021/jm7012858
BindingDB Entry DOI: 10.7270/Q2NP22QD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM21031
PNG
((2R,3S,6Z,14S,15S,17R)-6-[(tert-butylamino)methyli...)
Show SMILES COC[C@H]1OC(=O)C(=CNC(C)(C)C)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C
Show InChI InChI=1S/C27H37NO8/c1-13(29)35-16-10-26(5)15(8-9-17(26)30)19-21(16)27(6)18(12-34-7)36-24(33)14(11-28-25(2,3)4)20(27)23(32)22(19)31/h11,15-18,20,28,30H,8-10,12H2,1-7H3/t15?,16-,17+,18-,20?,26+,27+/m1/s1
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n/an/a>2.00E+4n/an/an/an/a7.430



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 51: 1319-23 (2008)


Article DOI: 10.1021/jm7012858
BindingDB Entry DOI: 10.7270/Q2NP22QD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM21032
PNG
((2R,3S,6Z,14S,15S,17R)-6-{[butyl(methyl)amino]meth...)
Show SMILES CCCCN(C)C=C1C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]2(C)[C@@H](COC)OC1=O
Show InChI InChI=1S/C28H39NO8/c1-7-8-11-29(5)13-16-22-25(33)24(32)21-17-9-10-19(31)27(17,3)12-18(36-15(2)30)23(21)28(22,4)20(14-35-6)37-26(16)34/h13,17-20,22,31H,7-12,14H2,1-6H3/t17?,18-,19+,20-,22?,27+,28+/m1/s1
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n/an/a 8.70E+3n/an/an/an/a7.430



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 51: 1319-23 (2008)


Article DOI: 10.1021/jm7012858
BindingDB Entry DOI: 10.7270/Q2NP22QD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM21033
PNG
((2R,3S,6Z,14S,15S,17R)-8,14-dihydroxy-3-(methoxyme...)
Show SMILES COC[C@H]1OC(=O)C(=CN2CCCC2)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C
Show InChI InChI=1S/C27H35NO8/c1-14(29)35-17-11-26(2)16(7-8-18(26)30)20-22(17)27(3)19(13-34-4)36-25(33)15(12-28-9-5-6-10-28)21(27)24(32)23(20)31/h12,16-19,21,30H,5-11,13H2,1-4H3/t16?,17-,18+,19-,21?,26+,27+/m1/s1
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n/an/a>2.00E+4n/an/an/an/a7.430



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 51: 1319-23 (2008)


Article DOI: 10.1021/jm7012858
BindingDB Entry DOI: 10.7270/Q2NP22QD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM21034
PNG
((1R,3R,5S,6S,18S)-6-hydroxy-18-(methoxymethyl)-1,5...)
Show SMILES COC[C@H]1OC(=O)c2coc3c2[C@@]1(C)C1=C(C2CC[C@H](O)[C@@]2(C)C[C@H]1OC(C)=O)C3=O
Show InChI InChI=1S/C23H26O8/c1-10(24)30-13-7-22(2)12(5-6-14(22)25)16-18(13)23(3)15(9-28-4)31-21(27)11-8-29-20(17(11)23)19(16)26/h8,12-15,25H,5-7,9H2,1-4H3/t12?,13-,14+,15-,22+,23+/m1/s1
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n/an/a 193n/an/an/an/a7.430



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 51: 1319-23 (2008)


Article DOI: 10.1021/jm7012858
BindingDB Entry DOI: 10.7270/Q2NP22QD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM21035
PNG
((2R,3S,6E,15S,17R)-6-{[bis(prop-2-en-1-yl)amino]me...)
Show SMILES COC[C@H]1OC(=O)C(=CN(CC=C)CC=C)C2C(=O)C(=O)C3=C([C@@H](C[C@@]4(C)C3CCC4=O)OC(C)=O)[C@@]12C
Show InChI InChI=1S/C29H35NO8/c1-7-11-30(12-8-2)14-17-23-26(34)25(33)22-18-9-10-20(32)28(18,4)13-19(37-16(3)31)24(22)29(23,5)21(15-36-6)38-27(17)35/h7-8,14,18-19,21,23H,1-2,9-13,15H2,3-6H3/t18?,19-,21-,23?,28+,29+/m1/s1
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n/an/a 3.10E+3n/an/an/an/a7.430



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 51: 1319-23 (2008)


Article DOI: 10.1021/jm7012858
BindingDB Entry DOI: 10.7270/Q2NP22QD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM21036
PNG
((2R,3S,6Z,14S,15S,17R)-6-({[3-(dimethylamino)propy...)
Show SMILES COC[C@H]1OC(=O)C(=CN(C)CCCN(C)C)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C
Show InChI InChI=1S/C29H42N2O8/c1-16(32)38-19-13-28(2)18(9-10-20(28)33)22-24(19)29(3)21(15-37-7)39-27(36)17(23(29)26(35)25(22)34)14-31(6)12-8-11-30(4)5/h14,18-21,23,33H,8-13,15H2,1-7H3/t18?,19-,20+,21-,23?,28+,29+/m1/s1
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n/an/a 2.92E+3n/an/an/an/a7.430



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 51: 1319-23 (2008)


Article DOI: 10.1021/jm7012858
BindingDB Entry DOI: 10.7270/Q2NP22QD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM21037
PNG
((2R,3S,6Z,14S,15S,17R)-6-({[3-(dimethylamino)propy...)
Show SMILES COC[C@H]1OC(=O)C(=CNCCCN(C)C)C2C(=O)C(=O)C3=C([C@@H](C[C@]4(C)[C@@H](O)CCC34)OC(C)=O)[C@@]12C
Show InChI InChI=1S/C28H40N2O8/c1-15(31)37-18-12-27(2)17(8-9-19(27)32)21-23(18)28(3)20(14-36-6)38-26(35)16(22(28)25(34)24(21)33)13-29-10-7-11-30(4)5/h13,17-20,22,29,32H,7-12,14H2,1-6H3/t17?,18-,19+,20-,22?,27+,28+/m1/s1
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n/an/a>2.00E+4n/an/an/an/a7.430



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 51: 1319-23 (2008)


Article DOI: 10.1021/jm7012858
BindingDB Entry DOI: 10.7270/Q2NP22QD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM21027
PNG
((2R,3S,6Z,14S,15S,17R)-6-[(diethylamino)methyliden...)
Show SMILES CCN(CC)C=C1C2C(=O)C(=O)C3=C([C@H](O)C[C@]4(C)[C@@H](O)CCC34)[C@@]2(C)[C@@H](COC)OC1=O
Show InChI InChI=1S/C25H35NO7/c1-6-26(7-2)11-13-19-22(30)21(29)18-14-8-9-16(28)24(14,3)10-15(27)20(18)25(19,4)17(12-32-5)33-23(13)31/h11,14-17,19,27-28H,6-10,12H2,1-5H3/t14?,15-,16+,17-,19?,24+,25+/m1/s1
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n/an/a>2.00E+4n/an/an/an/a7.430



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 51: 1319-23 (2008)


Article DOI: 10.1021/jm7012858
BindingDB Entry DOI: 10.7270/Q2NP22QD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35572
PNG
(JMC527081 Compound 5f | pyrazolo pyrimidine, 1)
Show SMILES Oc1cccc(c1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4cccnc4)CC3)c2n1
Show InChI InChI=1S/C26H29N7O2/c34-22-5-1-4-20(15-22)24-29-25(32-11-13-35-14-12-32)23-17-28-33(26(23)30-24)21-6-9-31(10-7-21)18-19-3-2-8-27-16-19/h1-5,8,15-17,21,34H,6-7,9-14,18H2
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n/an/a 9.60n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 5013-6 (2009)


Article DOI: 10.1021/jm900851f
BindingDB Entry DOI: 10.7270/Q2SJ1HZD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35573
PNG
(pyrazolo pyrimidine, 7)
Show SMILES CC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4cccnc4)CC3)c2n1
Show InChI InChI=1S/C28H32N8O2/c1-20(37)31-23-6-4-22(5-7-23)26-32-27(35-13-15-38-16-14-35)25-18-30-36(28(25)33-26)24-8-11-34(12-9-24)19-21-3-2-10-29-17-21/h2-7,10,17-18,24H,8-9,11-16,19H2,1H3,(H,31,37)
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n/an/a 7n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 5013-6 (2009)


Article DOI: 10.1021/jm900851f
BindingDB Entry DOI: 10.7270/Q2SJ1HZD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35574
PNG
(pyrazolo pyrimidine, 8)
Show SMILES CC(=O)Nc1cccc(c1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
Show InChI InChI=1S/C29H33N7O2/c1-21(37)31-24-9-5-8-23(18-24)27-32-28(35-14-16-38-17-15-35)26-19-30-36(29(26)33-27)25-10-12-34(13-11-25)20-22-6-3-2-4-7-22/h2-9,18-19,25H,10-17,20H2,1H3,(H,31,37)
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n/an/a 2.45E+3n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 5013-6 (2009)


Article DOI: 10.1021/jm900851f
BindingDB Entry DOI: 10.7270/Q2SJ1HZD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35575
PNG
(pyrazolo pyrimidine, 9)
Show SMILES COC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4cccnc4)CC3)c2n1
Show InChI InChI=1S/C28H32N8O3/c1-38-28(37)31-22-6-4-21(5-7-22)25-32-26(35-13-15-39-16-14-35)24-18-30-36(27(24)33-25)23-8-11-34(12-9-23)19-20-3-2-10-29-17-20/h2-7,10,17-18,23H,8-9,11-16,19H2,1H3,(H,31,37)
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n/an/a 4.60n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 5013-6 (2009)


Article DOI: 10.1021/jm900851f
BindingDB Entry DOI: 10.7270/Q2SJ1HZD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35576
PNG
(pyrazolo pyrimidine, 11)
Show SMILES CCOC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
Show InChI InChI=1S/C30H35N7O3/c1-2-40-30(38)32-24-10-8-23(9-11-24)27-33-28(36-16-18-39-19-17-36)26-20-31-37(29(26)34-27)25-12-14-35(15-13-25)21-22-6-4-3-5-7-22/h3-11,20,25H,2,12-19,21H2,1H3,(H,32,38)
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n/an/a 46n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 5013-6 (2009)


Article DOI: 10.1021/jm900851f
BindingDB Entry DOI: 10.7270/Q2SJ1HZD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35577
PNG
(pyrazolo pyrimidine, 12)
Show SMILES OCCOC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4cccnc4)CC3)c2n1
Show InChI InChI=1S/C29H34N8O4/c38-14-17-41-29(39)32-23-5-3-22(4-6-23)26-33-27(36-12-15-40-16-13-36)25-19-31-37(28(25)34-26)24-7-10-35(11-8-24)20-21-2-1-9-30-18-21/h1-6,9,18-19,24,38H,7-8,10-17,20H2,(H,32,39)
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n/an/a 1.5n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 5013-6 (2009)


Article DOI: 10.1021/jm900851f
BindingDB Entry DOI: 10.7270/Q2SJ1HZD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35578
PNG
(pyrazolo pyrimidine, 10)
Show SMILES CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4cccnc4)CC3)c2n1
Show InChI InChI=1S/C28H33N9O2/c1-29-28(38)32-22-6-4-21(5-7-22)25-33-26(36-13-15-39-16-14-36)24-18-31-37(27(24)34-25)23-8-11-35(12-9-23)19-20-3-2-10-30-17-20/h2-7,10,17-18,23H,8-9,11-16,19H2,1H3,(H2,29,32,38)
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n/an/a 0.380n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 5013-6 (2009)


Article DOI: 10.1021/jm900851f
BindingDB Entry DOI: 10.7270/Q2SJ1HZD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35579
PNG
(pyrazolo pyrimidine, 6)
Show SMILES CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCNCC3)c2n1
Show InChI InChI=1S/C22H28N8O2/c1-23-22(31)26-16-4-2-15(3-5-16)19-27-20(29-10-12-32-13-11-29)18-14-25-30(21(18)28-19)17-6-8-24-9-7-17/h2-5,14,17,24H,6-13H2,1H3,(H2,23,26,31)
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n/an/a 1.40n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 5013-6 (2009)


Article DOI: 10.1021/jm900851f
BindingDB Entry DOI: 10.7270/Q2SJ1HZD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35580
PNG
(pyrazolo pyrimidine, 13)
Show SMILES CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
Show InChI InChI=1S/C29H34N8O2/c1-30-29(38)32-23-9-7-22(8-10-23)26-33-27(36-15-17-39-18-16-36)25-19-31-37(28(25)34-26)24-11-13-35(14-12-24)20-21-5-3-2-4-6-21/h2-10,19,24H,11-18,20H2,1H3,(H2,30,32,38)
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n/an/a 0.520n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 5013-6 (2009)


Article DOI: 10.1021/jm900851f
BindingDB Entry DOI: 10.7270/Q2SJ1HZD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35581
PNG
(pyrazolo pyrimidine, 14)
Show SMILES CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(C)CC3)c2n1
Show InChI InChI=1S/C23H30N8O2/c1-24-23(32)26-17-5-3-16(4-6-17)20-27-21(30-11-13-33-14-12-30)19-15-25-31(22(19)28-20)18-7-9-29(2)10-8-18/h3-6,15,18H,7-14H2,1-2H3,(H2,24,26,32)
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n/an/a 22n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 5013-6 (2009)


Article DOI: 10.1021/jm900851f
BindingDB Entry DOI: 10.7270/Q2SJ1HZD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35582
PNG
(pyrazolo pyrimidine, 15)
Show SMILES CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(CC3)C(C)=O)c2n1
Show InChI InChI=1S/C24H30N8O3/c1-16(33)30-9-7-19(8-10-30)32-23-20(15-26-32)22(31-11-13-35-14-12-31)28-21(29-23)17-3-5-18(6-4-17)27-24(34)25-2/h3-6,15,19H,7-14H2,1-2H3,(H2,25,27,34)
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n/an/a 2.10n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 5013-6 (2009)


Article DOI: 10.1021/jm900851f
BindingDB Entry DOI: 10.7270/Q2SJ1HZD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35583
PNG
(pyrazolo pyrimidine, 16)
Show SMILES CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(CC3)C(=O)NC)c2n1
Show InChI InChI=1S/C24H31N9O3/c1-25-23(34)28-17-5-3-16(4-6-17)20-29-21(31-11-13-36-14-12-31)19-15-27-33(22(19)30-20)18-7-9-32(10-8-18)24(35)26-2/h3-6,15,18H,7-14H2,1-2H3,(H,26,35)(H2,25,28,34)
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n/an/a 2n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 5013-6 (2009)


Article DOI: 10.1021/jm900851f
BindingDB Entry DOI: 10.7270/Q2SJ1HZD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35584
PNG
(pyrazolo pyrimidine, 17)
Show SMILES CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(CC3)C(=O)N(C)C)c2n1
Show InChI InChI=1S/C25H33N9O3/c1-26-24(35)28-18-6-4-17(5-7-18)21-29-22(32-12-14-37-15-13-32)20-16-27-34(23(20)30-21)19-8-10-33(11-9-19)25(36)31(2)3/h4-7,16,19H,8-15H2,1-3H3,(H2,26,28,35)
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n/an/a 1.10n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 5013-6 (2009)


Article DOI: 10.1021/jm900851f
BindingDB Entry DOI: 10.7270/Q2SJ1HZD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35585
PNG
(pyrazolo pyrimidine, 18)
Show SMILES CNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(CC3)C(=O)OC)c2n1
Show InChI InChI=1S/C24H30N8O4/c1-25-23(33)27-17-5-3-16(4-6-17)20-28-21(30-11-13-36-14-12-30)19-15-26-32(22(19)29-20)18-7-9-31(10-8-18)24(34)35-2/h3-6,15,18H,7-14H2,1-2H3,(H2,25,27,33)
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n/an/a 0.460n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 5013-6 (2009)


Article DOI: 10.1021/jm900851f
BindingDB Entry DOI: 10.7270/Q2SJ1HZD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35586
PNG
(pyrazolo pyrimidine, 26)
Show SMILES O=C(Nc1ccncc1)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(CC3)C(=O)c3cccnc3)c2n1
Show InChI InChI=1S/C32H32N10O3/c43-31(23-2-1-11-34-20-23)41-14-9-26(10-15-41)42-30-27(21-35-42)29(40-16-18-45-19-17-40)38-28(39-30)22-3-5-24(6-4-22)36-32(44)37-25-7-12-33-13-8-25/h1-8,11-13,20-21,26H,9-10,14-19H2,(H2,33,36,37,44)
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n/an/a 0.830n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 5013-6 (2009)


Article DOI: 10.1021/jm900851f
BindingDB Entry DOI: 10.7270/Q2SJ1HZD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35587
PNG
(pyrazolo pyrimidine, 19)
Show SMILES COC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(CC3)C(=O)OC)c2n1
Show InChI InChI=1S/C24H29N7O5/c1-34-23(32)26-17-5-3-16(4-6-17)20-27-21(29-11-13-36-14-12-29)19-15-25-31(22(19)28-20)18-7-9-30(10-8-18)24(33)35-2/h3-6,15,18H,7-14H2,1-2H3,(H,26,32)
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n/an/a 4.30n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 5013-6 (2009)


Article DOI: 10.1021/jm900851f
BindingDB Entry DOI: 10.7270/Q2SJ1HZD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35588
PNG
(pyrazolo pyrimidine, 20)
Show SMILES COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)OCCO)cc1)N1CCOCC1
Show InChI InChI=1S/C25H31N7O6/c1-36-25(35)31-8-6-19(7-9-31)32-23-20(16-26-32)22(30-10-13-37-14-11-30)28-21(29-23)17-2-4-18(5-3-17)27-24(34)38-15-12-33/h2-5,16,19,33H,6-15H2,1H3,(H,27,34)
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n/an/a 1n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 5013-6 (2009)


Article DOI: 10.1021/jm900851f
BindingDB Entry DOI: 10.7270/Q2SJ1HZD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35589
PNG
(pyrazolo pyrimidine, 21)
Show SMILES CCNC(=O)Nc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(CC3)C(=O)OC)c2n1
Show InChI InChI=1S/C25H32N8O4/c1-3-26-24(34)28-18-6-4-17(5-7-18)21-29-22(31-12-14-37-15-13-31)20-16-27-33(23(20)30-21)19-8-10-32(11-9-19)25(35)36-2/h4-7,16,19H,3,8-15H2,1-2H3,(H2,26,28,34)
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n/an/a 0.320n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 5013-6 (2009)


Article DOI: 10.1021/jm900851f
BindingDB Entry DOI: 10.7270/Q2SJ1HZD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35590
PNG
(pyrazolo pyrimidine, 22)
Show SMILES COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)NCCF)cc1)N1CCOCC1
Show InChI InChI=1S/C25H31FN8O4/c1-37-25(36)33-10-6-19(7-11-33)34-23-20(16-28-34)22(32-12-14-38-15-13-32)30-21(31-23)17-2-4-18(5-3-17)29-24(35)27-9-8-26/h2-5,16,19H,6-15H2,1H3,(H2,27,29,35)
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n/an/a 0.610n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 5013-6 (2009)


Article DOI: 10.1021/jm900851f
BindingDB Entry DOI: 10.7270/Q2SJ1HZD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35591
PNG
(pyrazolo pyrimidine, 23)
Show SMILES COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)NC2CC2)cc1)N1CCOCC1
Show InChI InChI=1S/C26H32N8O4/c1-37-26(36)33-10-8-20(9-11-33)34-24-21(16-27-34)23(32-12-14-38-15-13-32)30-22(31-24)17-2-4-18(5-3-17)28-25(35)29-19-6-7-19/h2-5,16,19-20H,6-15H2,1H3,(H2,28,29,35)
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Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 5013-6 (2009)


Article DOI: 10.1021/jm900851f
BindingDB Entry DOI: 10.7270/Q2SJ1HZD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35592
PNG
(pyrazolo pyrimidine, 24)
Show SMILES COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2cccnc2)cc1)N1CCOCC1
Show InChI InChI=1S/C28H31N9O4/c1-40-28(39)36-11-8-22(9-12-36)37-26-23(18-30-37)25(35-13-15-41-16-14-35)33-24(34-26)19-4-6-20(7-5-19)31-27(38)32-21-3-2-10-29-17-21/h2-7,10,17-18,22H,8-9,11-16H2,1H3,(H2,31,32,38)
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n/an/a 0.200n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 5013-6 (2009)


Article DOI: 10.1021/jm900851f
BindingDB Entry DOI: 10.7270/Q2SJ1HZD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35593
PNG
(pyrazolo pyrimidine, 25)
Show SMILES COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccncc2)cc1)N1CCOCC1
Show InChI InChI=1S/C28H31N9O4/c1-40-28(39)36-12-8-22(9-13-36)37-26-23(18-30-37)25(35-14-16-41-17-15-35)33-24(34-26)19-2-4-20(5-3-19)31-27(38)32-21-6-10-29-11-7-21/h2-7,10-11,18,22H,8-9,12-17H2,1H3,(H2,29,31,32,38)
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n/an/a 0.300n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 5013-6 (2009)


Article DOI: 10.1021/jm900851f
BindingDB Entry DOI: 10.7270/Q2SJ1HZD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35594
PNG
(pyrazolo pyrimidine, 27)
Show SMILES COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(cc2)N2CCN(C)CC2)cc1)N1CCOCC1
Show InChI InChI=1S/C34H42N10O4/c1-40-15-17-41(18-16-40)27-9-7-26(8-10-27)37-33(45)36-25-5-3-24(4-6-25)30-38-31(42-19-21-48-22-20-42)29-23-35-44(32(29)39-30)28-11-13-43(14-12-28)34(46)47-2/h3-10,23,28H,11-22H2,1-2H3,(H2,36,37,45)
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n/an/a 0.340n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 5013-6 (2009)


Article DOI: 10.1021/jm900851f
BindingDB Entry DOI: 10.7270/Q2SJ1HZD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35595
PNG
(pyrazolo pyrimidine, 28)
Show SMILES COC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc(NC(=O)Nc2ccc(CO)cc2)cc1)N1CCOCC1
Show InChI InChI=1S/C30H34N8O5/c1-42-30(41)37-12-10-24(11-13-37)38-28-25(18-31-38)27(36-14-16-43-17-15-36)34-26(35-28)21-4-8-23(9-5-21)33-29(40)32-22-6-2-20(19-39)3-7-22/h2-9,18,24,39H,10-17,19H2,1H3,(H2,32,33,40)
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n/an/a 0.0800n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 5013-6 (2009)


Article DOI: 10.1021/jm900851f
BindingDB Entry DOI: 10.7270/Q2SJ1HZD
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35596
PNG
(pyrazolo pyrimidine, 5a)
Show SMILES Oc1cccc(c1)-c1nc(N2CCOCC2)c2cnn(C3CCNCC3)c2n1
Show InChI InChI=1S/C20H24N6O2/c27-16-3-1-2-14(12-16)18-23-19(25-8-10-28-11-9-25)17-13-22-26(20(17)24-18)15-4-6-21-7-5-15/h1-3,12-13,15,21,27H,4-11H2
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n/an/a 215n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 7081-9 (2009)


Article DOI: 10.1021/jm9012642
BindingDB Entry DOI: 10.7270/Q2NS0S73
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35597
PNG
(pyrazolo pyrimidine, 5b)
Show SMILES CC(=O)N1CCC(CC1)n1ncc2c(nc(nc12)-c1cccc(O)c1)N1CCOCC1
Show InChI InChI=1S/C22H26N6O3/c1-15(29)26-7-5-17(6-8-26)28-22-19(14-23-28)21(27-9-11-31-12-10-27)24-20(25-22)16-3-2-4-18(30)13-16/h2-4,13-14,17,30H,5-12H2,1H3
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n/an/a 49n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 7081-9 (2009)


Article DOI: 10.1021/jm9012642
BindingDB Entry DOI: 10.7270/Q2NS0S73
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35598
PNG
(pyrazolo pyrimidine, 5c)
Show SMILES Oc1cccc(c1)-c1nc(N2CCOCC2)c2cnn(C3CCN(CC3)C(=O)c3ccccc3)c2n1
Show InChI InChI=1S/C27H28N6O3/c34-22-8-4-7-20(17-22)24-29-25(31-13-15-36-16-14-31)23-18-28-33(26(23)30-24)21-9-11-32(12-10-21)27(35)19-5-2-1-3-6-19/h1-8,17-18,21,34H,9-16H2
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n/an/a 4n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 7081-9 (2009)


Article DOI: 10.1021/jm9012642
BindingDB Entry DOI: 10.7270/Q2NS0S73
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35599
PNG
(pyrazolo pyrimidine, 5d)
Show SMILES Oc1cccc(c1)-c1nc(N2CCOCC2)c2cnn(C3CCN(CC3)C(=O)c3cccnc3)c2n1
Show InChI InChI=1S/C26H27N7O3/c34-21-5-1-3-18(15-21)23-29-24(31-11-13-36-14-12-31)22-17-28-33(25(22)30-23)20-6-9-32(10-7-20)26(35)19-4-2-8-27-16-19/h1-5,8,15-17,20,34H,6-7,9-14H2
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n/an/a 6n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 7081-9 (2009)


Article DOI: 10.1021/jm9012642
BindingDB Entry DOI: 10.7270/Q2NS0S73
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35600
PNG
(pyrazolo pyrimidine, 5e)
Show SMILES Oc1cccc(c1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
Show InChI InChI=1S/C27H30N6O2/c34-23-8-4-7-21(17-23)25-29-26(32-13-15-35-16-14-32)24-18-28-33(27(24)30-25)22-9-11-31(12-10-22)19-20-5-2-1-3-6-20/h1-8,17-18,22,34H,9-16,19H2
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n/an/a 78n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 7081-9 (2009)


Article DOI: 10.1021/jm9012642
BindingDB Entry DOI: 10.7270/Q2NS0S73
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35572
PNG
(JMC527081 Compound 5f | pyrazolo pyrimidine, 1)
Show SMILES Oc1cccc(c1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4cccnc4)CC3)c2n1
Show InChI InChI=1S/C26H29N7O2/c34-22-5-1-4-20(15-22)24-29-25(32-11-13-35-14-12-32)23-17-28-33(26(23)30-24)21-6-9-31(10-7-21)18-19-3-2-8-27-16-19/h1-5,8,15-17,21,34H,6-7,9-14,18H2
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n/an/a 10n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 7081-9 (2009)


Article DOI: 10.1021/jm9012642
BindingDB Entry DOI: 10.7270/Q2NS0S73
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35601
PNG
(pyrazolo pyrimidine, 5g)
Show SMILES Oc1ccccc1-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
Show InChI InChI=1S/C27H30N6O2/c34-24-9-5-4-8-22(24)25-29-26(32-14-16-35-17-15-32)23-18-28-33(27(23)30-25)21-10-12-31(13-11-21)19-20-6-2-1-3-7-20/h1-9,18,21,34H,10-17,19H2
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n/an/a 1.27E+3n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 7081-9 (2009)


Article DOI: 10.1021/jm9012642
BindingDB Entry DOI: 10.7270/Q2NS0S73
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35602
PNG
(pyrazolo pyrimidine, 5h)
Show SMILES Oc1ccc(cc1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
Show InChI InChI=1S/C27H30N6O2/c34-23-8-6-21(7-9-23)25-29-26(32-14-16-35-17-15-32)24-18-28-33(27(24)30-25)22-10-12-31(13-11-22)19-20-4-2-1-3-5-20/h1-9,18,22,34H,10-17,19H2
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n/an/a 170n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 7081-9 (2009)


Article DOI: 10.1021/jm9012642
BindingDB Entry DOI: 10.7270/Q2NS0S73
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35603
PNG
(pyrazolo pyrimidine, 5i)
Show SMILES C(N1CCC(CC1)n1ncc2c(nc(nc12)-c1cccnc1)N1CCOCC1)c1ccccc1
Show InChI InChI=1S/C26H29N7O/c1-2-5-20(6-3-1)19-31-11-8-22(9-12-31)33-26-23(18-28-33)25(32-13-15-34-16-14-32)29-24(30-26)21-7-4-10-27-17-21/h1-7,10,17-18,22H,8-9,11-16,19H2
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n/an/a 695n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 7081-9 (2009)


Article DOI: 10.1021/jm9012642
BindingDB Entry DOI: 10.7270/Q2NS0S73
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35604
PNG
(pyrazolo pyrimidine, 5j)
Show SMILES C(N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccncc1)N1CCOCC1)c1ccccc1
Show InChI InChI=1S/C26H29N7O/c1-2-4-20(5-3-1)19-31-12-8-22(9-13-31)33-26-23(18-28-33)25(32-14-16-34-17-15-32)29-24(30-26)21-6-10-27-11-7-21/h1-7,10-11,18,22H,8-9,12-17,19H2
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n/an/a 7.30E+3n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 7081-9 (2009)


Article DOI: 10.1021/jm9012642
BindingDB Entry DOI: 10.7270/Q2NS0S73
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35605
PNG
(pyrazolo pyrimidine, 5k)
Show SMILES C(N1CCC(CC1)n1ncc2c(nc(nc12)-c1cnc2ccccc2c1)N1CCOCC1)c1ccccc1
Show InChI InChI=1S/C30H31N7O/c1-2-6-22(7-3-1)21-35-12-10-25(11-13-35)37-30-26(20-32-37)29(36-14-16-38-17-15-36)33-28(34-30)24-18-23-8-4-5-9-27(23)31-19-24/h1-9,18-20,25H,10-17,21H2
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n/an/a 120n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 7081-9 (2009)


Article DOI: 10.1021/jm9012642
BindingDB Entry DOI: 10.7270/Q2NS0S73
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35606
PNG
(pyrazolo pyrimidine, 5l)
Show SMILES C(N1CCC(CC1)n1ncc2c(nc(nc12)-c1ccc2ncccc2c1)N1CCOCC1)c1ccccc1
Show InChI InChI=1S/C30H31N7O/c1-2-5-22(6-3-1)21-35-13-10-25(11-14-35)37-30-26(20-32-37)29(36-15-17-38-18-16-36)33-28(34-30)24-8-9-27-23(19-24)7-4-12-31-27/h1-9,12,19-20,25H,10-11,13-18,21H2
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n/an/a 5.95E+3n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 7081-9 (2009)


Article DOI: 10.1021/jm9012642
BindingDB Entry DOI: 10.7270/Q2NS0S73
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase mTOR


(Homo sapiens (human))
BDBM35607
PNG
(pyrazolo pyrimidine, 5m)
Show SMILES O=c1[nH]c2ccc(cc2[nH]1)-c1nc(N2CCOCC2)c2cnn(C3CCN(Cc4ccccc4)CC3)c2n1
Show InChI InChI=1S/C28H30N8O2/c37-28-30-23-7-6-20(16-24(23)31-28)25-32-26(35-12-14-38-15-13-35)22-17-29-36(27(22)33-25)21-8-10-34(11-9-21)18-19-4-2-1-3-5-19/h1-7,16-17,21H,8-15,18H2,(H2,30,31,37)
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n/an/a 195n/an/an/an/a7.423



Wyeth Research



Assay Description
The enzyme was assayed in DELFIA format using purified FLAG-TOR in kinase buffer containing ATP and His6-S6K in the presence of inhibitor compounds. ...


J Med Chem 52: 7081-9 (2009)


Article DOI: 10.1021/jm9012642
BindingDB Entry DOI: 10.7270/Q2NS0S73
More data for this
Ligand-Target Pair
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