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Compile Data Set for Download or QSAR

Found 3945 hits Enz. Inhib. hit(s) with Target = 'Protein kinase B (Akt 1)'   
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
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM31427
PNG
(Peptidomimetic, 2)
Show SMILES CC(C)C(NC(=O)c1ccc(NC(=O)C(CCCN=C(N)N)NC(=O)C2CCCN2C(=O)C(CCCN=C(N)N)NC(=O)CNC(C)=O)cc1)C(=O)NC(Cc1ccccc1)C(=O)NCc1ccccc1
Show InChI InChI=1S/C49H68N14O8/c1-30(2)41(46(70)61-38(27-32-13-6-4-7-14-32)43(67)57-28-33-15-8-5-9-16-33)62-42(66)34-20-22-35(23-21-34)58-44(68)36(17-10-24-54-48(50)51)60-45(69)39-19-12-26-63(39)47(71)37(18-11-25-55-49(52)53)59-40(65)29-56-31(3)64/h4-9,13-16,20-23,30,36-39,41H,10-12,17-19,24-29H2,1-3H3,(H,56,64)(H,57,67)(H,58,68)(H,59,65)(H,60,69)(H,61,70)(H,62,66)(H4,50,51,54)(H4,52,53,55)
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n/an/a 2.80E+4n/an/an/an/a7.223



Yale University



Assay Description
A bead-based FP assay methodology, termed IMAP, has been developed for the serine/threonine kinase, AKT that allows for direct measurement of product...


Bioorg Med Chem 17: 1764-71 (2009)


Article DOI: 10.1016/j.bmc.2008.09.058
BindingDB Entry DOI: 10.7270/Q2XP737X
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM31448
PNG
(phenylaminoethyl guanidine deriv., 22ba)
Show SMILES COC(=O)c1ccc(cc1)-c1cc(ccc1NCCNC(N)=N)C(=O)Nc1ccc(cc1)N(Cc1ccccc1)Cc1ccccc1
Show InChI InChI=1S/C38H38N6O3/c1-47-37(46)30-14-12-29(13-15-30)34-24-31(16-21-35(34)41-22-23-42-38(39)40)36(45)43-32-17-19-33(20-18-32)44(25-27-8-4-2-5-9-27)26-28-10-6-3-7-11-28/h2-21,24,41H,22-23,25-26H2,1H3,(H,43,45)(H4,39,40,42)
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n/an/a 1.58E+5n/an/an/an/a7.223



Yale University



Assay Description
A bead-based FP assay methodology, termed IMAP, has been developed for the serine/threonine kinase, AKT that allows for direct measurement of product...


Bioorg Med Chem 17: 1764-71 (2009)


Article DOI: 10.1016/j.bmc.2008.09.058
BindingDB Entry DOI: 10.7270/Q2XP737X
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM31429
PNG
(Peptidomimetic, 4)
Show SMILES CC(C)C(NC(=O)c1ccc(NC(=O)C(CCCN=C(N)N)NC(=O)C2CCCN2C(=O)C(CCCN=C(N)N)NC(=O)CNC(C)=O)c(c1)-c1ccccc1)C(=O)NC(Cc1ccccc1)C(=O)NCc1ccccc1
Show InChI InChI=1S/C55H72N14O8/c1-34(2)47(52(76)67-44(30-36-16-7-4-8-17-36)49(73)63-32-37-18-9-5-10-19-37)68-48(72)39-25-26-41(40(31-39)38-20-11-6-12-21-38)65-50(74)42(22-13-27-60-54(56)57)66-51(75)45-24-15-29-69(45)53(77)43(23-14-28-61-55(58)59)64-46(71)33-62-35(3)70/h4-12,16-21,25-26,31,34,42-45,47H,13-15,22-24,27-30,32-33H2,1-3H3,(H,62,70)(H,63,73)(H,64,71)(H,65,74)(H,66,75)(H,67,76)(H,68,72)(H4,56,57,60)(H4,58,59,61)
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n/an/a>5.00E+5n/an/an/an/a7.223



Yale University



Assay Description
A bead-based FP assay methodology, termed IMAP, has been developed for the serine/threonine kinase, AKT that allows for direct measurement of product...


Bioorg Med Chem 17: 1764-71 (2009)


Article DOI: 10.1016/j.bmc.2008.09.058
BindingDB Entry DOI: 10.7270/Q2XP737X
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM31430
PNG
(Peptidomimetic, 5)
Show SMILES CC(C)C(NC(=O)c1ccc(NC(=O)C(CCCN=C(N)N)NC(=O)C2CCCN2C(=O)C(CCCN=C(N)N)NC(=O)CNC(C)=O)cc1-c1ccccc1)C(=O)NC(Cc1ccccc1)C(=O)NCc1ccccc1
Show InChI InChI=1S/C55H72N14O8/c1-34(2)47(52(76)67-44(30-36-16-7-4-8-17-36)49(73)63-32-37-18-9-5-10-19-37)68-48(72)40-26-25-39(31-41(40)38-20-11-6-12-21-38)64-50(74)42(22-13-27-60-54(56)57)66-51(75)45-24-15-29-69(45)53(77)43(23-14-28-61-55(58)59)65-46(71)33-62-35(3)70/h4-12,16-21,25-26,31,34,42-45,47H,13-15,22-24,27-30,32-33H2,1-3H3,(H,62,70)(H,63,73)(H,64,74)(H,65,71)(H,66,75)(H,67,76)(H,68,72)(H4,56,57,60)(H4,58,59,61)
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n/an/a 1.60E+4n/an/an/an/a7.223



Yale University



Assay Description
A bead-based FP assay methodology, termed IMAP, has been developed for the serine/threonine kinase, AKT that allows for direct measurement of product...


Bioorg Med Chem 17: 1764-71 (2009)


Article DOI: 10.1016/j.bmc.2008.09.058
BindingDB Entry DOI: 10.7270/Q2XP737X
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM31431
PNG
(Peptidomimetic, 6)
Show SMILES CC(C)C(NC(=O)c1ccc(NC(=O)C(CCCN=C(N)N)NC(=O)C2CCCN2C(=O)C(CCCN=C(N)N)NC(=O)CNC(C)=O)cc1-c1cccc2ccccc12)C(=O)NC(Cc1ccccc1)C(=O)NCc1ccccc1
Show InChI InChI=1S/C59H74N14O8/c1-36(2)51(56(80)71-48(32-38-16-6-4-7-17-38)53(77)67-34-39-18-8-5-9-19-39)72-52(76)44-28-27-41(33-45(44)43-23-12-21-40-20-10-11-22-42(40)43)68-54(78)46(24-13-29-64-58(60)61)70-55(79)49-26-15-31-73(49)57(81)47(25-14-30-65-59(62)63)69-50(75)35-66-37(3)74/h4-12,16-23,27-28,33,36,46-49,51H,13-15,24-26,29-32,34-35H2,1-3H3,(H,66,74)(H,67,77)(H,68,78)(H,69,75)(H,70,79)(H,71,80)(H,72,76)(H4,60,61,64)(H4,62,63,65)
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n/an/a 7.80E+4n/an/an/an/a7.223



Yale University



Assay Description
A bead-based FP assay methodology, termed IMAP, has been developed for the serine/threonine kinase, AKT that allows for direct measurement of product...


Bioorg Med Chem 17: 1764-71 (2009)


Article DOI: 10.1016/j.bmc.2008.09.058
BindingDB Entry DOI: 10.7270/Q2XP737X
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM31432
PNG
(Peptidomimetic, 7)
Show SMILES CC(C)C(NC(=O)c1ccc(NC(=O)C(CCCN=C(N)N)NC(C)=O)c(c1)-c1ccccc1)C(=O)NC(Cc1ccccc1)C(=O)NCc1ccccc1
Show InChI InChI=1S/C42H50N8O5/c1-27(2)37(41(55)49-36(24-29-14-7-4-8-15-29)39(53)46-26-30-16-9-5-10-17-30)50-38(52)32-21-22-34(33(25-32)31-18-11-6-12-19-31)48-40(54)35(47-28(3)51)20-13-23-45-42(43)44/h4-12,14-19,21-22,25,27,35-37H,13,20,23-24,26H2,1-3H3,(H,46,53)(H,47,51)(H,48,54)(H,49,55)(H,50,52)(H4,43,44,45)
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n/an/a 2.88E+5n/an/an/an/a7.223



Yale University



Assay Description
A bead-based FP assay methodology, termed IMAP, has been developed for the serine/threonine kinase, AKT that allows for direct measurement of product...


Bioorg Med Chem 17: 1764-71 (2009)


Article DOI: 10.1016/j.bmc.2008.09.058
BindingDB Entry DOI: 10.7270/Q2XP737X
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM31433
PNG
(Peptidomimetic, 8)
Show SMILES CC(C)C(NC(=O)c1ccc(NC(=O)C(CCCN=C(N)N)NC(C)=O)cc1-c1ccccc1)C(=O)NC(Cc1ccccc1)C(=O)NCc1ccccc1
Show InChI InChI=1S/C42H50N8O5/c1-27(2)37(41(55)49-36(24-29-14-7-4-8-15-29)39(53)46-26-30-16-9-5-10-17-30)50-38(52)33-22-21-32(25-34(33)31-18-11-6-12-19-31)48-40(54)35(47-28(3)51)20-13-23-45-42(43)44/h4-12,14-19,21-22,25,27,35-37H,13,20,23-24,26H2,1-3H3,(H,46,53)(H,47,51)(H,48,54)(H,49,55)(H,50,52)(H4,43,44,45)
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n/an/a 1.73E+5n/an/an/an/a7.223



Yale University



Assay Description
A bead-based FP assay methodology, termed IMAP, has been developed for the serine/threonine kinase, AKT that allows for direct measurement of product...


Bioorg Med Chem 17: 1764-71 (2009)


Article DOI: 10.1016/j.bmc.2008.09.058
BindingDB Entry DOI: 10.7270/Q2XP737X
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM31434
PNG
(Peptidomimetic, 9)
Show SMILES CC(C)C(NC(=O)c1ccc(NC(=O)C(CCCN=C(N)N)NC(C)=O)cc1)C(=O)NC(Cc1ccccc1)C(=O)NCc1ccccc1
Show InChI InChI=1S/C36H46N8O5/c1-23(2)31(35(49)43-30(21-25-11-6-4-7-12-25)33(47)40-22-26-13-8-5-9-14-26)44-32(46)27-16-18-28(19-17-27)42-34(48)29(41-24(3)45)15-10-20-39-36(37)38/h4-9,11-14,16-19,23,29-31H,10,15,20-22H2,1-3H3,(H,40,47)(H,41,45)(H,42,48)(H,43,49)(H,44,46)(H4,37,38,39)
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n/an/a 1.19E+5n/an/an/an/a7.223



Yale University



Assay Description
A bead-based FP assay methodology, termed IMAP, has been developed for the serine/threonine kinase, AKT that allows for direct measurement of product...


Bioorg Med Chem 17: 1764-71 (2009)


Article DOI: 10.1016/j.bmc.2008.09.058
BindingDB Entry DOI: 10.7270/Q2XP737X
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM31435
PNG
(phenylaminoethyl guanidine deriv., 21aa)
Show SMILES NC(=N)NCCNc1ccc(cc1)C(=O)Nc1ccc(cc1)N(Cc1ccccc1)Cc1ccccc1
Show InChI InChI=1S/C30H32N6O/c31-30(32)34-20-19-33-26-13-11-25(12-14-26)29(37)35-27-15-17-28(18-16-27)36(21-23-7-3-1-4-8-23)22-24-9-5-2-6-10-24/h1-18,33H,19-22H2,(H,35,37)(H4,31,32,34)
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n/an/a 9.60E+4n/an/an/an/a7.223



Yale University



Assay Description
A bead-based FP assay methodology, termed IMAP, has been developed for the serine/threonine kinase, AKT that allows for direct measurement of product...


Bioorg Med Chem 17: 1764-71 (2009)


Article DOI: 10.1016/j.bmc.2008.09.058
BindingDB Entry DOI: 10.7270/Q2XP737X
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM31436
PNG
(phenylaminoethyl guanidine deriv., 21ba)
Show SMILES NC(=N)NCCNc1ccc(cc1-c1ccccc1)C(=O)Nc1ccc(cc1)N(Cc1ccccc1)Cc1ccccc1
Show InChI InChI=1S/C36H36N6O/c37-36(38)40-23-22-39-34-21-16-30(24-33(34)29-14-8-3-9-15-29)35(43)41-31-17-19-32(20-18-31)42(25-27-10-4-1-5-11-27)26-28-12-6-2-7-13-28/h1-21,24,39H,22-23,25-26H2,(H,41,43)(H4,37,38,40)
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n/an/a 8.40E+4n/an/an/an/a7.223



Yale University



Assay Description
A bead-based FP assay methodology, termed IMAP, has been developed for the serine/threonine kinase, AKT that allows for direct measurement of product...


Bioorg Med Chem 17: 1764-71 (2009)


Article DOI: 10.1016/j.bmc.2008.09.058
BindingDB Entry DOI: 10.7270/Q2XP737X
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM31437
PNG
(phenylaminoethyl guanidine deriv., 21bb)
Show SMILES Cc1ccc(CN(Cc2ccc(C)cc2)c2ccc(NC(=O)c3ccc(NCCNC(N)=N)c(c3)-c3ccccc3)cc2)cc1
Show InChI InChI=1S/C38H40N6O/c1-27-8-12-29(13-9-27)25-44(26-30-14-10-28(2)11-15-30)34-19-17-33(18-20-34)43-37(45)32-16-21-36(41-22-23-42-38(39)40)35(24-32)31-6-4-3-5-7-31/h3-21,24,41H,22-23,25-26H2,1-2H3,(H,43,45)(H4,39,40,42)
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n/an/a 2.15E+5n/an/an/an/a7.223



Yale University



Assay Description
A bead-based FP assay methodology, termed IMAP, has been developed for the serine/threonine kinase, AKT that allows for direct measurement of product...


Bioorg Med Chem 17: 1764-71 (2009)


Article DOI: 10.1016/j.bmc.2008.09.058
BindingDB Entry DOI: 10.7270/Q2XP737X
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM31438
PNG
(phenylaminoethyl guanidine deriv., 21bc)
Show SMILES Cc1cccc(CN(Cc2cccc(C)c2)c2ccc(NC(=O)c3ccc(NCCNC(N)=N)c(c3)-c3ccccc3)cc2)c1
Show InChI InChI=1S/C38H40N6O/c1-27-8-6-10-29(22-27)25-44(26-30-11-7-9-28(2)23-30)34-17-15-33(16-18-34)43-37(45)32-14-19-36(41-20-21-42-38(39)40)35(24-32)31-12-4-3-5-13-31/h3-19,22-24,41H,20-21,25-26H2,1-2H3,(H,43,45)(H4,39,40,42)
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n/an/a 1.52E+5n/an/an/an/a7.223



Yale University



Assay Description
A bead-based FP assay methodology, termed IMAP, has been developed for the serine/threonine kinase, AKT that allows for direct measurement of product...


Bioorg Med Chem 17: 1764-71 (2009)


Article DOI: 10.1016/j.bmc.2008.09.058
BindingDB Entry DOI: 10.7270/Q2XP737X
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM31439
PNG
(phenylaminoethyl guanidine deriv., 21bd)
Show SMILES NC(=N)NCCNc1ccc(cc1-c1ccccc1)C(=O)Nc1ccc(cc1)N(Cc1ccc(cc1)-c1ccccc1)Cc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C48H44N6O/c49-48(50)52-31-30-51-46-29-24-42(32-45(46)41-14-8-3-9-15-41)47(55)53-43-25-27-44(28-26-43)54(33-35-16-20-39(21-17-35)37-10-4-1-5-11-37)34-36-18-22-40(23-19-36)38-12-6-2-7-13-38/h1-29,32,51H,30-31,33-34H2,(H,53,55)(H4,49,50,52)
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n/an/a 8.40E+4n/an/an/an/a7.223



Yale University



Assay Description
A bead-based FP assay methodology, termed IMAP, has been developed for the serine/threonine kinase, AKT that allows for direct measurement of product...


Bioorg Med Chem 17: 1764-71 (2009)


Article DOI: 10.1016/j.bmc.2008.09.058
BindingDB Entry DOI: 10.7270/Q2XP737X
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM31440
PNG
(phenylaminoethyl guanidine deriv., 21be)
Show SMILES NC(=N)NCCNc1ccc(cc1-c1ccccc1)C(=O)Nc1ccc(cc1)N(Cc1ccc(F)cc1)Cc1ccc(F)cc1
Show InChI InChI=1S/C36H34F2N6O/c37-29-11-6-25(7-12-29)23-44(24-26-8-13-30(38)14-9-26)32-17-15-31(16-18-32)43-35(45)28-10-19-34(41-20-21-42-36(39)40)33(22-28)27-4-2-1-3-5-27/h1-19,22,41H,20-21,23-24H2,(H,43,45)(H4,39,40,42)
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n/an/a 5.50E+4n/an/an/an/a7.223



Yale University



Assay Description
A bead-based FP assay methodology, termed IMAP, has been developed for the serine/threonine kinase, AKT that allows for direct measurement of product...


Bioorg Med Chem 17: 1764-71 (2009)


Article DOI: 10.1016/j.bmc.2008.09.058
BindingDB Entry DOI: 10.7270/Q2XP737X
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM31441
PNG
(phenylaminoethyl guanidine deriv., 21bf)
Show SMILES NC(=N)NCCNc1ccc(cc1-c1ccccc1)C(=O)Nc1ccc(cc1)N(Cc1cccc2ccccc12)Cc1cccc2ccccc12
Show InChI InChI=1S/C44H40N6O/c45-44(46)48-27-26-47-42-25-20-34(28-41(42)33-10-2-1-3-11-33)43(51)49-37-21-23-38(24-22-37)50(29-35-16-8-14-31-12-4-6-18-39(31)35)30-36-17-9-15-32-13-5-7-19-40(32)36/h1-25,28,47H,26-27,29-30H2,(H,49,51)(H4,45,46,48)
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n/an/a 4.30E+4n/an/an/an/a7.223



Yale University



Assay Description
A bead-based FP assay methodology, termed IMAP, has been developed for the serine/threonine kinase, AKT that allows for direct measurement of product...


Bioorg Med Chem 17: 1764-71 (2009)


Article DOI: 10.1016/j.bmc.2008.09.058
BindingDB Entry DOI: 10.7270/Q2XP737X
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM31442
PNG
(phenylaminoethyl guanidine deriv., 21bg)
Show SMILES CC(C)c1ccc(CN(Cc2ccc(cc2)C(C)C)c2ccc(NC(=O)c3ccc(NCCNC(N)=N)c(c3)-c3ccccc3)cc2)cc1
Show InChI InChI=1S/C42H48N6O/c1-29(2)33-14-10-31(11-15-33)27-48(28-32-12-16-34(17-13-32)30(3)4)38-21-19-37(20-22-38)47-41(49)36-18-23-40(45-24-25-46-42(43)44)39(26-36)35-8-6-5-7-9-35/h5-23,26,29-30,45H,24-25,27-28H2,1-4H3,(H,47,49)(H4,43,44,46)
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n/an/a 2.80E+4n/an/an/an/a7.223



Yale University



Assay Description
A bead-based FP assay methodology, termed IMAP, has been developed for the serine/threonine kinase, AKT that allows for direct measurement of product...


Bioorg Med Chem 17: 1764-71 (2009)


Article DOI: 10.1016/j.bmc.2008.09.058
BindingDB Entry DOI: 10.7270/Q2XP737X
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM31443
PNG
(phenylaminoethyl guanidine deriv., 21bh)
Show SMILES NC(=N)NCCNc1ccc(cc1-c1ccccc1)C(=O)Nc1ccc(cc1)N(Cc1ccc2ccccc2c1)Cc1ccc2ccccc2c1
Show InChI InChI=1S/C44H40N6O/c45-44(46)48-25-24-47-42-23-18-38(28-41(42)35-10-2-1-3-11-35)43(51)49-39-19-21-40(22-20-39)50(29-31-14-16-33-8-4-6-12-36(33)26-31)30-32-15-17-34-9-5-7-13-37(34)27-32/h1-23,26-28,47H,24-25,29-30H2,(H,49,51)(H4,45,46,48)
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n/an/a 2.30E+4n/an/an/an/a7.223



Yale University



Assay Description
A bead-based FP assay methodology, termed IMAP, has been developed for the serine/threonine kinase, AKT that allows for direct measurement of product...


Bioorg Med Chem 17: 1764-71 (2009)


Article DOI: 10.1016/j.bmc.2008.09.058
BindingDB Entry DOI: 10.7270/Q2XP737X
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM31444
PNG
(phenylaminoethyl guanidine deriv., 21bi)
Show SMILES NC(=N)NCCNc1ccc(cc1-c1ccccc1)C(=O)Nc1ccc(cc1)N(Cc1ccc(cc1)C#N)Cc1ccc(cc1)C#N
Show InChI InChI=1S/C38H34N8O/c39-23-27-6-10-29(11-7-27)25-46(26-30-12-8-28(24-40)9-13-30)34-17-15-33(16-18-34)45-37(47)32-14-19-36(43-20-21-44-38(41)42)35(22-32)31-4-2-1-3-5-31/h1-19,22,43H,20-21,25-26H2,(H,45,47)(H4,41,42,44)
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n/an/a 1.90E+4n/an/an/an/a7.223



Yale University



Assay Description
A bead-based FP assay methodology, termed IMAP, has been developed for the serine/threonine kinase, AKT that allows for direct measurement of product...


Bioorg Med Chem 17: 1764-71 (2009)


Article DOI: 10.1016/j.bmc.2008.09.058
BindingDB Entry DOI: 10.7270/Q2XP737X
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM31445
PNG
(phenylaminoethyl guanidine deriv., 21cg)
Show SMILES CC(C)c1ccc(CN(Cc2ccc(cc2)C(C)C)c2ccc(NC(=O)c3ccc(NCCNC(N)=N)c(c3)-c3ccc4ccccc4c3)cc2)cc1
Show InChI InChI=1S/C46H50N6O/c1-31(2)35-13-9-33(10-14-35)29-52(30-34-11-15-36(16-12-34)32(3)4)42-22-20-41(21-23-42)51-45(53)40-19-24-44(49-25-26-50-46(47)48)43(28-40)39-18-17-37-7-5-6-8-38(37)27-39/h5-24,27-28,31-32,49H,25-26,29-30H2,1-4H3,(H,51,53)(H4,47,48,50)
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n/an/a 3.80E+4n/an/an/an/a7.223



Yale University



Assay Description
A bead-based FP assay methodology, termed IMAP, has been developed for the serine/threonine kinase, AKT that allows for direct measurement of product...


Bioorg Med Chem 17: 1764-71 (2009)


Article DOI: 10.1016/j.bmc.2008.09.058
BindingDB Entry DOI: 10.7270/Q2XP737X
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM31446
PNG
(phenylaminoethyl guanidine deriv., 21ci)
Show SMILES NC(=N)NCCNc1ccc(cc1-c1ccc2ccccc2c1)C(=O)Nc1ccc(cc1)N(Cc1ccc(cc1)C#N)Cc1ccc(cc1)C#N
Show InChI InChI=1S/C42H36N8O/c43-25-29-5-9-31(10-6-29)27-50(28-32-11-7-30(26-44)8-12-32)38-18-16-37(17-19-38)49-41(51)36-15-20-40(47-21-22-48-42(45)46)39(24-36)35-14-13-33-3-1-2-4-34(33)23-35/h1-20,23-24,47H,21-22,27-28H2,(H,49,51)(H4,45,46,48)
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n/an/a 1.70E+4n/an/an/an/a7.223



Yale University



Assay Description
A bead-based FP assay methodology, termed IMAP, has been developed for the serine/threonine kinase, AKT that allows for direct measurement of product...


Bioorg Med Chem 17: 1764-71 (2009)


Article DOI: 10.1016/j.bmc.2008.09.058
BindingDB Entry DOI: 10.7270/Q2XP737X
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM31447
PNG
(phenylaminoethyl guanidine deriv., 22aa)
Show SMILES CC(=O)Nc1ccc(cc1)-c1cc(ccc1NCCNC(N)=N)C(=O)Nc1ccc(cc1)N(Cc1ccccc1)Cc1ccccc1
Show InChI InChI=1S/C38H39N7O2/c1-27(46)43-32-15-12-30(13-16-32)35-24-31(14-21-36(35)41-22-23-42-38(39)40)37(47)44-33-17-19-34(20-18-33)45(25-28-8-4-2-5-9-28)26-29-10-6-3-7-11-29/h2-21,24,41H,22-23,25-26H2,1H3,(H,43,46)(H,44,47)(H4,39,40,42)
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n/an/a 2.53E+5n/an/an/an/a7.223



Yale University



Assay Description
A bead-based FP assay methodology, termed IMAP, has been developed for the serine/threonine kinase, AKT that allows for direct measurement of product...


Bioorg Med Chem 17: 1764-71 (2009)


Article DOI: 10.1016/j.bmc.2008.09.058
BindingDB Entry DOI: 10.7270/Q2XP737X
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM31428
PNG
(Peptidomimetic, 3)
Show SMILES CC(C)C(NC(=O)c1ccc(NC(=O)C(CCCN=C(N)N)NC(=O)C2CCCN2C(=O)C(CCCN=C(N)N)NC(=O)CNC(C)=O)c(C)c1)C(=O)NC(Cc1ccccc1)C(=O)NCc1ccccc1
Show InChI InChI=1S/C50H70N14O8/c1-30(2)42(47(71)62-39(27-33-14-7-5-8-15-33)44(68)58-28-34-16-9-6-10-17-34)63-43(67)35-21-22-36(31(3)26-35)60-45(69)37(18-11-23-55-49(51)52)61-46(70)40-20-13-25-64(40)48(72)38(19-12-24-56-50(53)54)59-41(66)29-57-32(4)65/h5-10,14-17,21-22,26,30,37-40,42H,11-13,18-20,23-25,27-29H2,1-4H3,(H,57,65)(H,58,68)(H,59,66)(H,60,69)(H,61,70)(H,62,71)(H,63,67)(H4,51,52,55)(H4,53,54,56)
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n/an/a 5.00E+4n/an/an/an/a7.223



Yale University



Assay Description
A bead-based FP assay methodology, termed IMAP, has been developed for the serine/threonine kinase, AKT that allows for direct measurement of product...


Bioorg Med Chem 17: 1764-71 (2009)


Article DOI: 10.1016/j.bmc.2008.09.058
BindingDB Entry DOI: 10.7270/Q2XP737X
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM25470
PNG
(N-[4-(pyridin-4-yl)-1,3-thiazol-2-yl]-2,3-dihydro-...)
Show SMILES O=C(Nc1nc(cs1)-c1ccncc1)C1COc2ccccc2O1
Show InChI InChI=1S/C17H13N3O3S/c21-16(15-9-22-13-3-1-2-4-14(13)23-15)20-17-19-12(10-24-17)11-5-7-18-8-6-11/h1-8,10,15H,9H2,(H,19,20,21)
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n/an/a>2.00E+4n/an/an/an/a7.322



The Scripps Research Institute



Assay Description
The mixture of a S6-peptide, ATP, and test compound was added to the wells using a BioRAPTR FRD Workstation (Aurora Discovery). Reaction was started ...


J Med Chem 51: 6642-5 (2008)


Article DOI: 10.1021/jm800986w
BindingDB Entry DOI: 10.7270/Q2JS9NRN
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM25471
PNG
(N-[4-(pyridin-4-yl)phenyl]-2,3-dihydro-1,4-benzodi...)
Show SMILES O=C(Nc1ccc(cc1)-c1ccncc1)C1COc2ccccc2O1
Show InChI InChI=1S/C20H16N2O3/c23-20(19-13-24-17-3-1-2-4-18(17)25-19)22-16-7-5-14(6-8-16)15-9-11-21-12-10-15/h1-12,19H,13H2,(H,22,23)
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n/an/a 6.44E+3n/an/an/an/a7.322



The Scripps Research Institute



Assay Description
The mixture of a S6-peptide, ATP, and test compound was added to the wells using a BioRAPTR FRD Workstation (Aurora Discovery). Reaction was started ...


J Med Chem 51: 6642-5 (2008)


Article DOI: 10.1021/jm800986w
BindingDB Entry DOI: 10.7270/Q2JS9NRN
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM25474
PNG
(JMC516642 Compound 5 | N-{2-[2-(dimethylamino)etho...)
Show SMILES CN(C)CCOc1cc(ccc1NC(=O)C1COc2ccccc2O1)-c1cn[nH]c1
Show InChI InChI=1S/C22H24N4O4/c1-26(2)9-10-28-20-11-15(16-12-23-24-13-16)7-8-17(20)25-22(27)21-14-29-18-5-3-4-6-19(18)30-21/h3-8,11-13,21H,9-10,14H2,1-2H3,(H,23,24)(H,25,27)
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n/an/a 7.49E+3n/an/an/an/a7.322



The Scripps Research Institute



Assay Description
The mixture of a S6-peptide, ATP, and test compound was added to the wells using a BioRAPTR FRD Workstation (Aurora Discovery). Reaction was started ...


J Med Chem 51: 6642-5 (2008)


Article DOI: 10.1021/jm800986w
BindingDB Entry DOI: 10.7270/Q2JS9NRN
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM25473
PNG
(N-[2-methoxy-4-(1H-pyrazol-4-yl)phenyl]-2,3-dihydr...)
Show SMILES COc1cc(ccc1NC(=O)C1COc2ccccc2O1)-c1cn[nH]c1
Show InChI InChI=1S/C19H17N3O4/c1-24-17-8-12(13-9-20-21-10-13)6-7-14(17)22-19(23)18-11-25-15-4-2-3-5-16(15)26-18/h2-10,18H,11H2,1H3,(H,20,21)(H,22,23)
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n/an/a 8.82E+3n/an/an/an/a7.322



The Scripps Research Institute



Assay Description
The mixture of a S6-peptide, ATP, and test compound was added to the wells using a BioRAPTR FRD Workstation (Aurora Discovery). Reaction was started ...


J Med Chem 51: 6642-5 (2008)


Article DOI: 10.1021/jm800986w
BindingDB Entry DOI: 10.7270/Q2JS9NRN
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM25472
PNG
(CHEMBL519123 | N-[4-(1H-pyrazol-4-yl)phenyl]-2,3-d...)
Show SMILES O=C(Nc1ccc(cc1)-c1cn[nH]c1)C1COc2ccccc2O1
Show InChI InChI=1S/C18H15N3O3/c22-18(17-11-23-15-3-1-2-4-16(15)24-17)21-14-7-5-12(6-8-14)13-9-19-20-10-13/h1-10,17H,11H2,(H,19,20)(H,21,22)
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n/an/a 1.41E+3n/an/an/an/a7.322



The Scripps Research Institute



Assay Description
The mixture of a S6-peptide, ATP, and test compound was added to the wells using a BioRAPTR FRD Workstation (Aurora Discovery). Reaction was started ...


J Med Chem 51: 6642-5 (2008)


Article DOI: 10.1021/jm800986w
BindingDB Entry DOI: 10.7270/Q2JS9NRN
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM29506
PNG
(Lactoquinomycin | Lactoquinomycin A)
Show SMILES C[C@H]1OC(C[C@H]([C@@H]1O)N(C)C)c1ccc2C(=O)C3=C([C@@H](C)O[C@@H]4CC(=O)O[C@H]34)C(=O)c2c1O
Show InChI InChI=1S/C24H27NO8/c1-9-17-19(24-15(31-9)8-16(26)33-24)22(29)12-6-5-11(21(28)18(12)23(17)30)14-7-13(25(3)4)20(27)10(2)32-14/h5-6,9-10,13-15,20,24,27-28H,7-8H2,1-4H3/t9-,10-,13-,14?,15-,20-,24+/m1/s1
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n/an/a 149n/an/an/an/a7.422



Wyeth Research



Assay Description
AKT1 was assayed using constitutively active Myr-AKT1 in low-binding 96-well plates. The kinase reactions were initiated by the addition of assay mix...


J Med Chem 52: 2181-4 (2009)


Article DOI: 10.1021/jm900075g
BindingDB Entry DOI: 10.7270/Q2V69GW9
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM29523
PNG
(Pyranonaphthoquinone (PNQ) lactone, 11m)
Show SMILES CC1(C)O[C@@H]2CC(=O)O[C@@H]2C2=C1C(=O)c1ccccc1C2=O
Show InChI InChI=1S/C17H14O5/c1-17(2)13-12(16-10(22-17)7-11(18)21-16)14(19)8-5-3-4-6-9(8)15(13)20/h3-6,10,16H,7H2,1-2H3/t10-,16+/m1/s1
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n/an/a 1.44E+3n/an/an/an/a7.422



Wyeth Research



Assay Description
AKT1 was assayed using constitutively active Myr-AKT1 in low-binding 96-well plates. The kinase reactions were initiated by the addition of assay mix...


J Med Chem 52: 2181-4 (2009)


Article DOI: 10.1021/jm900075g
BindingDB Entry DOI: 10.7270/Q2V69GW9
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM29508
PNG
(Frenolicin B)
Show SMILES CCC[C@H]1O[C@@H]2CC(=O)O[C@@H]2C2=C1C(=O)c1c(O)cccc1C2=O
Show InChI InChI=1S/C18H16O6/c1-2-4-10-14-15(18-11(23-10)7-12(20)24-18)16(21)8-5-3-6-9(19)13(8)17(14)22/h3,5-6,10-11,18-19H,2,4,7H2,1H3/t10-,11-,18+/m1/s1
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n/an/a 198n/an/an/an/a7.422



Wyeth Research



Assay Description
AKT1 was assayed using constitutively active Myr-AKT1 in low-binding 96-well plates. The kinase reactions were initiated by the addition of assay mix...


J Med Chem 52: 2181-4 (2009)


Article DOI: 10.1021/jm900075g
BindingDB Entry DOI: 10.7270/Q2V69GW9
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM29509
PNG
(Frenolicin B analogue, 4)
Show SMILES CCC[C@H]1O[C@@H]2CC(=O)O[C@@H]2C2=C1C(=O)c1c(OC)cccc1C2=O
Show InChI InChI=1S/C19H18O6/c1-3-5-11-15-16(19-12(24-11)8-13(20)25-19)17(21)9-6-4-7-10(23-2)14(9)18(15)22/h4,6-7,11-12,19H,3,5,8H2,1-2H3/t11-,12-,19+/m1/s1
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n/an/a 497n/an/an/an/a7.422



Wyeth Research



Assay Description
AKT1 was assayed using constitutively active Myr-AKT1 in low-binding 96-well plates. The kinase reactions were initiated by the addition of assay mix...


J Med Chem 52: 2181-4 (2009)


Article DOI: 10.1021/jm900075g
BindingDB Entry DOI: 10.7270/Q2V69GW9
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM29510
PNG
(Deoxyfrenolicin)
Show SMILES CCC[C@H]1O[C@H](CC(O)=O)CC2=C1C(=O)c1c(O)cccc1C2=O
Show InChI InChI=1S/C18H18O6/c1-2-4-13-16-11(7-9(24-13)8-14(20)21)17(22)10-5-3-6-12(19)15(10)18(16)23/h3,5-6,9,13,19H,2,4,7-8H2,1H3,(H,20,21)/t9-,13+/m0/s1
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n/an/a 424n/an/an/an/a7.422



Wyeth Research



Assay Description
AKT1 was assayed using constitutively active Myr-AKT1 in low-binding 96-well plates. The kinase reactions were initiated by the addition of assay mix...


J Med Chem 52: 2181-4 (2009)


Article DOI: 10.1021/jm900075g
BindingDB Entry DOI: 10.7270/Q2V69GW9
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM29511
PNG
(Pyranonaphthoquinone (PNQ) lactone, 11a)
Show SMILES O=C1C[C@H]2OCC3=C([C@H]2O1)C(=O)c1ccccc1C3=O
Show InChI InChI=1S/C15H10O5/c16-11-5-10-15(20-11)12-9(6-19-10)13(17)7-3-1-2-4-8(7)14(12)18/h1-4,10,15H,5-6H2/t10-,15+/m1/s1
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n/an/a 44n/an/an/an/a7.422



Wyeth Research



Assay Description
AKT1 was assayed using constitutively active Myr-AKT1 in low-binding 96-well plates. The kinase reactions were initiated by the addition of assay mix...


J Med Chem 52: 2181-4 (2009)


Article DOI: 10.1021/jm900075g
BindingDB Entry DOI: 10.7270/Q2V69GW9
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM29512
PNG
(Pyranonaphthoquinone (PNQ) lactone, 11b)
Show SMILES O=C1C[C@H]2O[C@H](c3cccs3)C3=C([C@H]2O1)C(=O)c1ccccc1C3=O
Show InChI InChI=1S/C19H12O5S/c20-13-8-11-18(24-13)14-15(19(23-11)12-6-3-7-25-12)17(22)10-5-2-1-4-9(10)16(14)21/h1-7,11,18-19H,8H2/t11-,18+,19-/m1/s1
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n/an/a 57n/an/an/an/a7.422



Wyeth Research



Assay Description
AKT1 was assayed using constitutively active Myr-AKT1 in low-binding 96-well plates. The kinase reactions were initiated by the addition of assay mix...


J Med Chem 52: 2181-4 (2009)


Article DOI: 10.1021/jm900075g
BindingDB Entry DOI: 10.7270/Q2V69GW9
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM29513
PNG
(Pyranonaphthoquinone (PNQ) lactone, 11c)
Show SMILES O=C1C[C@H]2O[C@H](COCc3ccccc3)C3=C([C@H]2O1)C(=O)c1ccccc1C3=O
Show InChI InChI=1S/C23H18O6/c24-18-10-16-23(29-18)20-19(21(25)14-8-4-5-9-15(14)22(20)26)17(28-16)12-27-11-13-6-2-1-3-7-13/h1-9,16-17,23H,10-12H2/t16-,17-,23+/m1/s1
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n/an/a 72n/an/an/an/a7.422



Wyeth Research



Assay Description
AKT1 was assayed using constitutively active Myr-AKT1 in low-binding 96-well plates. The kinase reactions were initiated by the addition of assay mix...


J Med Chem 52: 2181-4 (2009)


Article DOI: 10.1021/jm900075g
BindingDB Entry DOI: 10.7270/Q2V69GW9
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM29514
PNG
(Pyranonaphthoquinone (PNQ) lactone, 11d)
Show SMILES Oc1ccc(cc1)[C@@H]1O[C@@H]2CC(=O)O[C@@H]2C2=C1C(=O)c1ccccc1C2=O
Show InChI InChI=1S/C21H14O6/c22-11-7-5-10(6-8-11)20-16-17(21-14(26-20)9-15(23)27-21)19(25)13-4-2-1-3-12(13)18(16)24/h1-8,14,20-22H,9H2/t14-,20+,21+/m1/s1
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n/an/a 80n/an/an/an/a7.422



Wyeth Research



Assay Description
AKT1 was assayed using constitutively active Myr-AKT1 in low-binding 96-well plates. The kinase reactions were initiated by the addition of assay mix...


J Med Chem 52: 2181-4 (2009)


Article DOI: 10.1021/jm900075g
BindingDB Entry DOI: 10.7270/Q2V69GW9
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM29515
PNG
(Pyranonaphthoquinone (PNQ) lactone, 11e)
Show SMILES O=C1C[C@@H]2O[C@H](c3ccsc3)C3=C([C@@H]2O1)C(=O)c1ccccc1C3=O
Show InChI InChI=1S/C19H12O5S/c20-13-7-12-19(24-13)15-14(18(23-12)9-5-6-25-8-9)16(21)10-3-1-2-4-11(10)17(15)22/h1-6,8,12,18-19H,7H2/t12-,18+,19+/m0/s1
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n/an/a 99n/an/an/an/a7.422



Wyeth Research



Assay Description
AKT1 was assayed using constitutively active Myr-AKT1 in low-binding 96-well plates. The kinase reactions were initiated by the addition of assay mix...


J Med Chem 52: 2181-4 (2009)


Article DOI: 10.1021/jm900075g
BindingDB Entry DOI: 10.7270/Q2V69GW9
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM29516
PNG
(Pyranonaphthoquinone (PNQ) lactone, 11f)
Show SMILES O=C1C[C@H]2O[C@@H](c3ccsc3)C3=C([C@H]2O1)C(=O)c1ccccc1C3=O
Show InChI InChI=1S/C19H12O5S/c20-13-7-12-19(24-13)15-14(18(23-12)9-5-6-25-8-9)16(21)10-3-1-2-4-11(10)17(15)22/h1-6,8,12,18-19H,7H2/t12-,18+,19+/m1/s1
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n/an/a 122n/an/an/an/a7.422



Wyeth Research



Assay Description
AKT1 was assayed using constitutively active Myr-AKT1 in low-binding 96-well plates. The kinase reactions were initiated by the addition of assay mix...


J Med Chem 52: 2181-4 (2009)


Article DOI: 10.1021/jm900075g
BindingDB Entry DOI: 10.7270/Q2V69GW9
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM29517
PNG
(Pyranonaphthoquinone (PNQ) lactone, 11g)
Show SMILES C[C@H]1O[C@@H]2CC(=O)O[C@@H]2C2=C1C(=O)c1ccccc1C2=O
Show InChI InChI=1S/C16H12O5/c1-7-12-13(16-10(20-7)6-11(17)21-16)15(19)9-5-3-2-4-8(9)14(12)18/h2-5,7,10,16H,6H2,1H3/t7-,10-,16+/m1/s1
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n/an/a 150n/an/an/an/a7.422



Wyeth Research



Assay Description
AKT1 was assayed using constitutively active Myr-AKT1 in low-binding 96-well plates. The kinase reactions were initiated by the addition of assay mix...


J Med Chem 52: 2181-4 (2009)


Article DOI: 10.1021/jm900075g
BindingDB Entry DOI: 10.7270/Q2V69GW9
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM29518
PNG
(Pyranonaphthoquinone (PNQ) lactone, 11h)
Show SMILES CCC[C@H]1O[C@@H]2CC(=O)O[C@@H]2C2=C1C(=O)c1ccccc1C2=O
Show InChI InChI=1S/C18H16O5/c1-2-5-11-14-15(18-12(22-11)8-13(19)23-18)17(21)10-7-4-3-6-9(10)16(14)20/h3-4,6-7,11-12,18H,2,5,8H2,1H3/t11-,12-,18+/m1/s1
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n/an/a 163n/an/an/an/a7.422



Wyeth Research



Assay Description
AKT1 was assayed using constitutively active Myr-AKT1 in low-binding 96-well plates. The kinase reactions were initiated by the addition of assay mix...


J Med Chem 52: 2181-4 (2009)


Article DOI: 10.1021/jm900075g
BindingDB Entry DOI: 10.7270/Q2V69GW9
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM29519
PNG
(Pyranonaphthoquinone (PNQ) lactone, 11i)
Show SMILES O=C1C[C@H]2O[C@]3(CCCC3)C3=C([C@H]2O1)C(=O)c1ccccc1C3=O
Show InChI InChI=1S/C19H16O5/c20-13-9-12-18(23-13)14-15(19(24-12)7-3-4-8-19)17(22)11-6-2-1-5-10(11)16(14)21/h1-2,5-6,12,18H,3-4,7-9H2/t12-,18+/m1/s1
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n/an/a 295n/an/an/an/a7.422



Wyeth Research



Assay Description
AKT1 was assayed using constitutively active Myr-AKT1 in low-binding 96-well plates. The kinase reactions were initiated by the addition of assay mix...


J Med Chem 52: 2181-4 (2009)


Article DOI: 10.1021/jm900075g
BindingDB Entry DOI: 10.7270/Q2V69GW9
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM29520
PNG
(Pyranonaphthoquinone (PNQ) lactone, 11j)
Show SMILES Oc1cccc(c1)[C@@H]1O[C@@H]2CC(=O)O[C@@H]2C2=C1C(=O)c1ccccc1C2=O
Show InChI InChI=1S/C21H14O6/c22-11-5-3-4-10(8-11)20-16-17(21-14(26-20)9-15(23)27-21)19(25)13-7-2-1-6-12(13)18(16)24/h1-8,14,20-22H,9H2/t14-,20+,21+/m1/s1
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n/an/a 350n/an/an/an/a7.422



Wyeth Research



Assay Description
AKT1 was assayed using constitutively active Myr-AKT1 in low-binding 96-well plates. The kinase reactions were initiated by the addition of assay mix...


J Med Chem 52: 2181-4 (2009)


Article DOI: 10.1021/jm900075g
BindingDB Entry DOI: 10.7270/Q2V69GW9
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM29521
PNG
(Pyranonaphthoquinone (PNQ) lactone, 11k)
Show SMILES CCC[C@@H]1O[C@@H]2CC(=O)O[C@@H]2C2=C1C(=O)c1ccccc1C2=O
Show InChI InChI=1S/C18H16O5/c1-2-5-11-14-15(18-12(22-11)8-13(19)23-18)17(21)10-7-4-3-6-9(10)16(14)20/h3-4,6-7,11-12,18H,2,5,8H2,1H3/t11-,12+,18-/m0/s1
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n/an/a 383n/an/an/an/a7.422



Wyeth Research



Assay Description
AKT1 was assayed using constitutively active Myr-AKT1 in low-binding 96-well plates. The kinase reactions were initiated by the addition of assay mix...


J Med Chem 52: 2181-4 (2009)


Article DOI: 10.1021/jm900075g
BindingDB Entry DOI: 10.7270/Q2V69GW9
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM29522
PNG
(Pyranonaphthoquinone (PNQ) lactone, 11l)
Show SMILES Nc1ccc(cc1)[C@@H]1O[C@@H]2CC(=O)O[C@@H]2C2=C1C(=O)c1ccccc1C2=O
Show InChI InChI=1S/C21H15NO5/c22-11-7-5-10(6-8-11)20-16-17(21-14(26-20)9-15(23)27-21)19(25)13-4-2-1-3-12(13)18(16)24/h1-8,14,20-21H,9,22H2/t14-,20+,21+/m1/s1
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n/an/a 850n/an/an/an/a7.422



Wyeth Research



Assay Description
AKT1 was assayed using constitutively active Myr-AKT1 in low-binding 96-well plates. The kinase reactions were initiated by the addition of assay mix...


J Med Chem 52: 2181-4 (2009)


Article DOI: 10.1021/jm900075g
BindingDB Entry DOI: 10.7270/Q2V69GW9
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (human))
BDBM29507
PNG
(Kalafungin | Kalamycin | cid_283138)
Show SMILES C[C@H]1O[C@@H]2CC(=O)O[C@@H]2C2=C1C(=O)c1c(O)cccc1C2=O
Show InChI InChI=1S/C16H12O6/c1-6-11-13(16-9(21-6)5-10(18)22-16)14(19)7-3-2-4-8(17)12(7)15(11)20/h2-4,6,9,16-17H,5H2,1H3/t6-,9-,16+/m1/s1
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n/an/a 313n/an/an/an/a7.422



Wyeth Research



Assay Description
AKT1 was assayed using constitutively active Myr-AKT1 in low-binding 96-well plates. The kinase reactions were initiated by the addition of assay mix...


J Med Chem 52: 2181-4 (2009)


Article DOI: 10.1021/jm900075g
BindingDB Entry DOI: 10.7270/Q2V69GW9
More data for this
Ligand-Target Pair
Protein kinase B (Akt 1)


(Homo sapiens (human))
BDBM15131
PNG
(5-indazolyl pyridine 3 | 5-{5-[(2S)-2-amino-3-(1H-...)
Show SMILES Cc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2c[nH]c3ccccc23)c1
Show InChI InChI=1S/C24H23N5O/c1-15-22-10-16(6-7-24(22)29-28-15)17-9-20(13-26-11-17)30-14-19(25)8-18-12-27-23-5-3-2-4-21(18)23/h2-7,9-13,19,27H,8,14,25H2,1H3,(H,28,29)/t19-/m0/s1
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0.160 -55.3n/an/an/an/an/a7.522



Abbott Laboratories



Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat...


Bioorg Med Chem Lett 16: 3740-4 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.046
BindingDB Entry DOI: 10.7270/Q2ZP44C9
More data for this
Ligand-Target Pair
Protein kinase B (Akt 1)


(Homo sapiens (human))
BDBM15136
PNG
(5-indazolyl pyridine 11e | 5-{5-[(2S)-2-amino-3-(2...)
Show SMILES COc1ccc2ccccc2c1C[C@H](N)COc1cncc(c1)-c1ccc2[nH]nc(C)c2c1
Show InChI InChI=1S/C27H26N4O2/c1-17-24-12-19(7-9-26(24)31-30-17)20-11-22(15-29-14-20)33-16-21(28)13-25-23-6-4-3-5-18(23)8-10-27(25)32-2/h3-12,14-15,21H,13,16,28H2,1-2H3,(H,30,31)/t21-/m0/s1
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1.10 -50.6n/an/an/an/an/a7.522



Abbott Laboratories



Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat...


Bioorg Med Chem Lett 16: 3740-4 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.046
BindingDB Entry DOI: 10.7270/Q2ZP44C9
More data for this
Ligand-Target Pair
Protein kinase B (Akt 1)


(Homo sapiens (human))
BDBM15067
PNG
((2S)-1-(1H-indol-3-yl)-3-(5-isoquinolin-6-ylpyridi...)
Show SMILES N[C@H](COc1cncc(c1)-c1ccc2cnccc2c1)Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C25H22N4O/c26-22(10-21-14-29-25-4-2-1-3-24(21)25)16-30-23-11-20(13-28-15-23)17-5-6-19-12-27-8-7-18(19)9-17/h1-9,11-15,22,29H,10,16,26H2/t22-/m0/s1
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2 -49.2n/an/an/an/an/a7.522



Abbott Laboratories



Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat...


Bioorg Med Chem Lett 16: 3740-4 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.046
BindingDB Entry DOI: 10.7270/Q2ZP44C9
More data for this
Ligand-Target Pair
Protein kinase B (Akt 1)


(Homo sapiens (human))
BDBM15132
PNG
(5-indazolyl pyridine 11a | 5-{5-[(2S)-2-amino-3-(2...)
Show SMILES Cc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2c(C)[nH]c3ccccc23)c1
Show InChI InChI=1S/C25H25N5O/c1-15-22(21-5-3-4-6-24(21)28-15)11-19(26)14-31-20-9-18(12-27-13-20)17-7-8-25-23(10-17)16(2)29-30-25/h3-10,12-13,19,28H,11,14,26H2,1-2H3,(H,29,30)/t19-/m0/s1
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2.10 -49.0n/an/an/an/an/a7.522



Abbott Laboratories



Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat...


Bioorg Med Chem Lett 16: 3740-4 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.046
BindingDB Entry DOI: 10.7270/Q2ZP44C9
More data for this
Ligand-Target Pair
Protein kinase B (Akt 1)


(Homo sapiens (human))
BDBM15134
PNG
(5-indazolyl pyridine 11c | 5-{5-[(2S)-2-amino-3-(n...)
Show SMILES Cc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C26H24N4O/c1-17-25-13-21(8-9-26(25)30-29-17)22-12-24(15-28-14-22)31-16-23(27)11-18-6-7-19-4-2-3-5-20(19)10-18/h2-10,12-15,23H,11,16,27H2,1H3,(H,29,30)/t23-/m0/s1
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3.20 -48.0n/an/an/an/an/a7.522



Abbott Laboratories



Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat...


Bioorg Med Chem Lett 16: 3740-4 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.046
BindingDB Entry DOI: 10.7270/Q2ZP44C9
More data for this
Ligand-Target Pair
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