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Compile Data Set for Download or QSAR

Found 60 hits of ic50 for UniProtKB: P31751   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM431867
PNG
(US10550114, Compound 1a)
Show SMILES C=CC(=O)Nc1ccc2[nH]c(=O)n(C3CCN(Cc4ccc(cc4)-c4nc5cc[nH]c(=O)c5cc4-c4ccccc4)CC3)c2c1
Show InChI InChI=1S/C36H32N6O3/c1-2-33(43)38-26-12-13-31-32(20-26)42(36(45)40-31)27-15-18-41(19-16-27)22-23-8-10-25(11-9-23)34-28(24-6-4-3-5-7-24)21-29-30(39-34)14-17-37-35(29)44/h2-14,17,20-21,27H,1,15-16,18-19,22H2,(H,37,44)(H,38,43)(H,40,45)
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n/an/a 0.200n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00073
BindingDB Entry DOI: 10.7270/Q2028WJ8
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM182517
PNG
(US9145392, 218)
Show SMILES Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccc(F)c(c2)C(F)(F)F)c1Cl
Show InChI InChI=1S/C24H26ClF4N7/c25-20-21(30)31-14-32-23(20)35-8-4-15(5-9-35)22-33-19(13-36(22)11-10-34-6-1-7-34)16-2-3-18(26)17(12-16)24(27,28)29/h2-3,12-15H,1,4-11H2,(H2,30,31,32)
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n/an/a 1n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM50550738
PNG
(CHEMBL4792262)
Show SMILES [O-][N+](=O)c1ccc(NC(=O)C(N(C(=O)c2ccccc2I)c2ccccc2)c2ccccc2)cc1
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n/an/a 1.30n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human AKT assessed as inhibition of substrate phosphorylation using AKTide-2T as substrate

Citation and Details

Article DOI: 10.1016/j.ejmech.2019.111875
BindingDB Entry DOI: 10.7270/Q2X92FXB
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM50572156
PNG
(CHEMBL4853207)
Show SMILES OC(=O)c1cccc2c(N[C@H](CN3CCC3)c3ccc(Cl)c(c3)C(F)(F)F)ncnc12 |r|
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n/an/a 1.40n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM50550740
PNG
(CHEMBL4780030)
Show SMILES [O-][N+](=O)c1ccc(NC(=O)C(N(Cc2ccccc2)C(=O)Cc2ccccc2)c2ccccc2)cc1
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n/an/a 2.10n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human AKT assessed as inhibition of substrate phosphorylation using AKTide-2T as substrate

Citation and Details

Article DOI: 10.1016/j.ejmech.2019.111875
BindingDB Entry DOI: 10.7270/Q2X92FXB
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM182373
PNG
(US9145392, 74)
Show SMILES Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccc(F)c(c2)C(F)(F)F)c1C#N
Show InChI InChI=1S/C25H26F4N8/c26-20-3-2-17(12-19(20)25(27,28)29)21-14-37(11-10-35-6-1-7-35)23(34-21)16-4-8-36(9-5-16)24-18(13-30)22(31)32-15-33-24/h2-3,12,14-16H,1,4-11H2,(H2,31,32,33)
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n/an/a 2.20n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM182529
PNG
(US9145392, 230)
Show SMILES CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(c1)C(F)(F)F
Show InChI InChI=1S/C26H31F4N7/c1-2-19-23(31)32-16-33-25(19)36-10-6-17(7-11-36)24-34-22(15-37(24)13-12-35-8-3-9-35)18-4-5-21(27)20(14-18)26(28,29)30/h4-5,14-17H,2-3,6-13H2,1H3,(H2,31,32,33)
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n/an/a 4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM182519
PNG
(US9145392, 220)
Show SMILES Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccc(F)c(c2)C(F)(F)F)c1C=C
Show InChI InChI=1S/C26H29F4N7/c1-2-19-23(31)32-16-33-25(19)36-10-6-17(7-11-36)24-34-22(15-37(24)13-12-35-8-3-9-35)18-4-5-21(27)20(14-18)26(28,29)30/h2,4-5,14-17H,1,3,6-13H2,(H2,31,32,33)
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n/an/a 4.20n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM182390
PNG
(US9145392, 91)
Show SMILES CN(C)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C1CC1)-c1ccc(F)c(c1)C(F)(F)F
Show InChI InChI=1S/C26H31F4N7/c1-35(2)11-12-37-14-21(18-5-6-20(27)19(13-18)26(28,29)30)34-24(37)17-7-9-36(10-8-17)25-22(16-3-4-16)23(31)32-15-33-25/h5-6,13-17H,3-4,7-12H2,1-2H3,(H2,31,32,33)
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n/an/a 4.80n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM50593633
PNG
(ARQ 092 | ARQ 092 FREE BASE | ARQ-092 | Arq-092 | ...)
Show SMILES Nc1ncccc1-c1nc2ccc(nc2n1-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
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n/an/a 5n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00073
BindingDB Entry DOI: 10.7270/Q2028WJ8
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM182413
PNG
(US9145392, 114)
Show SMILES CC(C)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(c1)C(F)(F)F
Show InChI InChI=1S/C27H33F4N7/c1-17(2)23-24(32)33-16-34-26(23)37-10-6-18(7-11-37)25-35-22(15-38(25)13-12-36-8-3-9-36)19-4-5-21(28)20(14-19)27(29,30)31/h4-5,14-18H,3,6-13H2,1-2H3,(H2,32,33,34)
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n/an/a 6.60n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM182307
PNG
(US9145392, 8)
Show SMILES CN(C)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C#N)-c1ccc(F)c(c1)C(F)(F)F
Show InChI InChI=1S/C24H26F4N8/c1-34(2)9-10-36-13-20(16-3-4-19(25)18(11-16)24(26,27)28)33-22(36)15-5-7-35(8-6-15)23-17(12-29)21(30)31-14-32-23/h3-4,11,13-15H,5-10H2,1-2H3,(H2,30,31,32)
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n/an/a 6.90n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM50572155
PNG
(CHEMBL4876889)
Show SMILES Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccc(F)c(c2)C(F)(F)F)c1C1CCC1
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n/an/a 7.30n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM50550739
PNG
(CHEMBL4788683)
Show SMILES [O-][N+](=O)c1ccc(NC(=O)C(N(C(=O)c2ccc(cc2)C(F)(F)F)c2ccccc2)c2ccc(cc2)[N+]([O-])=O)cc1
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n/an/a 8.80n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human AKT assessed as inhibition of substrate phosphorylation using AKTide-2T as substrate

Citation and Details

Article DOI: 10.1016/j.ejmech.2019.111875
BindingDB Entry DOI: 10.7270/Q2X92FXB
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM182372
PNG
(US9145392, 73)
Show SMILES CN(C)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C=C)-c1ccc(F)c(c1)C(F)(F)F
Show InChI InChI=1S/C25H29F4N7/c1-4-18-22(30)31-15-32-24(18)35-9-7-16(8-10-35)23-33-21(14-36(23)12-11-34(2)3)17-5-6-20(26)19(13-17)25(27,28)29/h4-6,13-16H,1,7-12H2,2-3H3,(H2,30,31,32)
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n/an/a 9.10n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM182381
PNG
(US9145392, 82)
Show SMILES CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN(C)C)-c1ccc(F)c(c1)C(F)(F)F
Show InChI InChI=1S/C25H31F4N7/c1-4-18-22(30)31-15-32-24(18)35-9-7-16(8-10-35)23-33-21(14-36(23)12-11-34(2)3)17-5-6-20(26)19(13-17)25(27,28)29/h5-6,13-16H,4,7-12H2,1-3H3,(H2,30,31,32)
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n/an/a 12n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM182377
PNG
(US9145392, 78)
Show SMILES NC(=O)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(c1)C(F)(F)F
Show InChI InChI=1S/C25H28F4N8O/c26-18-3-2-16(12-17(18)25(27,28)29)19-13-37(11-10-35-6-1-7-35)23(34-19)15-4-8-36(9-5-15)24-20(22(31)38)21(30)32-14-33-24/h2-3,12-15H,1,4-11H2,(H2,31,38)(H2,30,32,33)
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n/an/a 16n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM50528415
PNG
(CHEMBL4457064)
Show SMILES O[C@H]([C@@H](O)C(O)=O)C(O)=O.Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(F)c(F)c1 |r,wU:26.26,wD:1.0,2.2,31.33,(23.87,-52,;23.87,-53.52,;25.19,-54.29,;25.19,-55.81,;26.51,-53.52,;27.84,-54.29,;26.51,-52,;22.55,-54.29,;21.23,-53.52,;22.55,-55.81,;7.85,-50.48,;7.53,-51.98,;6.12,-52.61,;6.28,-54.14,;7.78,-54.46,;8.41,-55.87,;8.56,-53.13,;10.09,-52.98,;11.12,-54.12,;12.52,-53.5,;12.37,-51.97,;10.87,-51.64,;10.24,-50.24,;13.85,-54.28,;13.85,-55.82,;15.19,-53.51,;16.52,-54.28,;16.52,-55.82,;17.85,-56.59,;19.19,-55.83,;19.19,-54.28,;17.86,-53.51,;17.87,-51.98,;16.53,-51.21,;16.53,-49.66,;17.86,-48.89,;17.86,-47.35,;19.2,-49.66,;20.53,-48.88,;19.2,-51.21,)|
Show InChI InChI=1S/C20H18Cl2F2N4O2.C4H6O6/c1-28-18(13(21)8-26-28)12-7-17(30-19(12)22)20(29)27-16-9-25-5-4-11(16)10-2-3-14(23)15(24)6-10;5-1(3(7)8)2(6)4(9)10/h2-3,6-8,11,16,25H,4-5,9H2,1H3,(H,27,29);1-2,5-6H,(H,7,8)(H,9,10)/t11-,16+;1-,2-/m01/s1
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n/an/a 21n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of Akt in human LNCaP cells assessed as reduction in PRAS40 phosphorylation at T246 residue after 1 hr by ELISA

J Med Chem 62: 7264-7288 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00891
BindingDB Entry DOI: 10.7270/Q2XW4P7W
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM182518
PNG
(US9145392, 219)
Show SMILES Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccc(F)c(c2)C(F)(F)F)c1-c1ccc(F)cc1
Show InChI InChI=1S/C30H30F5N7/c31-22-5-2-19(3-6-22)26-27(36)37-18-38-29(26)41-12-8-20(9-13-41)28-39-25(17-42(28)15-14-40-10-1-11-40)21-4-7-24(32)23(16-21)30(33,34)35/h2-7,16-18,20H,1,8-15H2,(H2,36,37,38)
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n/an/a 23n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM50528416
PNG
(CHEMBL4440965)
Show SMILES CNC(=O)C[C@@H]1C[C@H]([C@@H](CN1)NC(=O)c1cc(c(Cl)o1)-c1c(Cl)cnn1C)c1ccc(F)c(F)c1 |r,wU:8.11,5.4,wD:7.29,(76.34,-11.8,;75,-12.56,;73.67,-11.79,;73.68,-10.25,;72.34,-12.55,;71.01,-11.78,;71.01,-10.23,;69.68,-9.47,;68.34,-10.24,;68.34,-11.77,;69.67,-12.55,;67.01,-9.46,;65.68,-10.23,;65.67,-11.77,;64.34,-9.46,;62.93,-10.08,;61.9,-8.93,;62.68,-7.6,;62.05,-6.19,;64.18,-7.92,;60.37,-9.09,;59.59,-10.42,;60.22,-11.83,;58.09,-10.1,;57.93,-8.57,;59.34,-7.94,;59.66,-6.44,;69.68,-7.94,;68.35,-7.17,;68.35,-5.62,;69.68,-4.85,;69.67,-3.31,;71.01,-5.62,;72.34,-4.84,;71.02,-7.17,)|
Show InChI InChI=1S/C23H23Cl2F2N5O3/c1-28-20(33)7-12-6-13(11-3-4-16(26)17(27)5-11)18(10-29-12)31-23(34)19-8-14(22(25)35-19)21-15(24)9-30-32(21)2/h3-5,8-9,12-13,18,29H,6-7,10H2,1-2H3,(H,28,33)(H,31,34)/t12-,13-,18+/m0/s1
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n/an/a 44n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of Akt in human LNCaP cells assessed as reduction in PRAS40 phosphorylation at T246 residue after 1 hr by ELISA

J Med Chem 62: 7264-7288 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00891
BindingDB Entry DOI: 10.7270/Q2XW4P7W
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM182337
PNG
(US9145392, 38)
Show SMILES CN(C)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C(N)=O)-c1ccc(F)c(c1)C(F)(F)F
Show InChI InChI=1S/C24H28F4N8O/c1-34(2)9-10-36-12-18(15-3-4-17(25)16(11-15)24(26,27)28)33-22(36)14-5-7-35(8-6-14)23-19(21(30)37)20(29)31-13-32-23/h3-4,11-14H,5-10H2,1-2H3,(H2,30,37)(H2,29,31,32)
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n/an/a 84n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM182356
PNG
(US9145392, 57)
Show SMILES Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(F)c(c2)C(F)(F)F)c1-c1ccc(F)cc1
Show InChI InChI=1S/C31H32F5N7/c32-23-6-3-20(4-7-23)27-28(37)38-19-39-30(27)42-13-9-21(10-14-42)29-40-26(18-43(29)16-15-41-11-1-2-12-41)22-5-8-25(33)24(17-22)31(34,35)36/h3-8,17-19,21H,1-2,9-16H2,(H2,37,38,39)
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n/an/a 140n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM182367
PNG
(US9145392, 68)
Show SMILES CN(C)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1-c1ccc(F)cc1)-c1ccc(F)c(c1)C(F)(F)F
Show InChI InChI=1S/C29H30F5N7/c1-39(2)13-14-41-16-24(20-5-8-23(31)22(15-20)29(32,33)34)38-27(41)19-9-11-40(12-10-19)28-25(26(35)36-17-37-28)18-3-6-21(30)7-4-18/h3-8,15-17,19H,9-14H2,1-2H3,(H2,35,36,37)
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n/an/a 230n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM182306
PNG
(US9145392, 7)
Show SMILES Cn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C#N)-c1ccc(F)c(c1)C(F)(F)F
Show InChI InChI=1S/C21H19F4N7/c1-31-10-17(13-2-3-16(22)15(8-13)21(23,24)25)30-19(31)12-4-6-32(7-5-12)20-14(9-26)18(27)28-11-29-20/h2-3,8,10-12H,4-7H2,1H3,(H2,27,28,29)
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n/an/a 260n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM182361
PNG
(US9145392, 62)
Show SMILES Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCCC2)-c2ccc(F)c(c2)C(F)(F)F)c1-c1ccc(F)cc1
Show InChI InChI=1S/C32H34F5N7/c33-24-7-4-21(5-8-24)28-29(38)39-20-40-31(28)43-14-10-22(11-15-43)30-41-27(19-44(30)17-16-42-12-2-1-3-13-42)23-6-9-26(34)25(18-23)32(35,36)37/h4-9,18-20,22H,1-3,10-17H2,(H2,38,39,40)
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n/an/a 350n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM224325
PNG
(US10080750, Compound 2 | US9321760, 2 | US9662330,...)
Show SMILES NCC(N1CCN(CC1)c1ncnc(N)c1-c1ccc(F)cc1)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C23H24F4N6/c24-18-7-3-16(4-8-18)20-21(29)30-14-31-22(20)33-11-9-32(10-12-33)19(13-28)15-1-5-17(6-2-15)23(25,26)27/h1-8,14,19H,9-13,28H2,(H2,29,30,31)
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n/an/a 350n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM182308
PNG
(US9145392, 9)
Show SMILES COc1c(N)ncnc1N1CCC(CC1)c1nc(cn1C)-c1ccc(F)c(c1)C(F)(F)F
Show InChI InChI=1S/C21H22F4N6O/c1-30-10-16(13-3-4-15(22)14(9-13)21(23,24)25)29-19(30)12-5-7-31(8-6-12)20-17(32-2)18(26)27-11-28-20/h3-4,9-12H,5-8H2,1-2H3,(H2,26,27,28)
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n/an/a 518n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM182354
PNG
(US9145392, 55)
Show SMILES Cc1ncc(s1)-c1c(N)ncnc1N1CCC(CC1)c1nc(cn1C)-c1ccc(F)c(c1)C(F)(F)F
Show InChI InChI=1S/C24H23F4N7S/c1-13-30-10-19(36-13)20-21(29)31-12-32-23(20)35-7-5-14(6-8-35)22-33-18(11-34(22)2)15-3-4-17(25)16(9-15)24(26,27)28/h3-4,9-12,14H,5-8H2,1-2H3,(H2,29,31,32)
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n/an/a 850n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM182347
PNG
(US9145392, 48)
Show SMILES Cn1cc(nc1C1CCN(CC1)c1ncnc(N)c1-c1cncnc1)-c1ccc(F)c(c1)C(F)(F)F
Show InChI InChI=1S/C24H22F4N8/c1-35-11-19(15-2-3-18(25)17(8-15)24(26,27)28)34-22(35)14-4-6-36(7-5-14)23-20(21(29)32-13-33-23)16-9-30-12-31-10-16/h2-3,8-14H,4-7H2,1H3,(H2,29,32,33)
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n/an/a 880n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM182338
PNG
(US9145392, 39)
Show SMILES Cn1cc(nc1C1CCN(CC1)c1ncnc(N)c1-c1ccncc1)-c1ccc(F)c(c1)C(F)(F)F
Show InChI InChI=1S/C25H23F4N7/c1-35-13-20(17-2-3-19(26)18(12-17)25(27,28)29)34-23(35)16-6-10-36(11-7-16)24-21(22(30)32-14-33-24)15-4-8-31-9-5-15/h2-5,8-9,12-14,16H,6-7,10-11H2,1H3,(H2,30,32,33)
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n/an/a 930n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM182311
PNG
(US9145392, 12)
Show SMILES Cn1cc(nc1C1CCN(CC1)c1cc(N)ncn1)-c1ccc(F)c(c1)C(F)(F)F
Show InChI InChI=1S/C20H20F4N6/c1-29-10-16(13-2-3-15(21)14(8-13)20(22,23)24)28-19(29)12-4-6-30(7-5-12)18-9-17(25)26-11-27-18/h2-3,8-12H,4-7H2,1H3,(H2,25,26,27)
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n/an/a>1.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM224350
PNG
(US10080750, Compound 27 | US9321760, 27 | US966233...)
Show SMILES Nc1ncnc(N2CCN(CC2)C(CN2CCC2)c2ccc(cc2)C(F)(F)F)c1-c1ccc(F)cc1
Show InChI InChI=1S/C26H28F4N6/c27-21-8-4-19(5-9-21)23-24(31)32-17-33-25(23)36-14-12-35(13-15-36)22(16-34-10-1-11-34)18-2-6-20(7-3-18)26(28,29)30/h2-9,17,22H,1,10-16H2,(H2,31,32,33)
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n/an/a>1.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM224477
PNG
(US10080750, Compound 155 | US9321760, 155 | US9662...)
Show SMILES NCC(N1CCN(CC1)c1ncnc(N)c1-c1ccc(F)cc1)c1ccc(F)c(c1)C(F)(F)F
Show InChI InChI=1S/C23H23F5N6/c24-16-4-1-14(2-5-16)20-21(30)31-13-32-22(20)34-9-7-33(8-10-34)19(12-29)15-3-6-18(25)17(11-15)23(26,27)28/h1-6,11,13,19H,7-10,12,29H2,(H2,30,31,32)
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n/an/a>1.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM224481
PNG
(US10080750, Compound 159 | US9321760, 159 | US9662...)
Show SMILES NCC(N1CCN(CC1)c1ncnc(N)c1-c1ccc(F)cc1)c1ccc(F)cc1
Show InChI InChI=1S/C22H24F2N6/c23-17-5-1-15(2-6-17)19(13-25)29-9-11-30(12-10-29)22-20(21(26)27-14-28-22)16-3-7-18(24)8-4-16/h1-8,14,19H,9-13,25H2,(H2,26,27,28)
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TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM224329
PNG
(US10080750, Compound 6 | US9321760, 6 | US9662330,...)
Show SMILES NCC(N1CCN(CC1)c1ncnc(N)c1-c1ccc(F)cc1)c1ccccc1
Show InChI InChI=1S/C22H25FN6/c23-18-8-6-17(7-9-18)20-21(25)26-15-27-22(20)29-12-10-28(11-13-29)19(14-24)16-4-2-1-3-5-16/h1-9,15,19H,10-14,24H2,(H2,25,26,27)
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n/an/a>1.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM50095232
PNG
(6-Methoxy-7-(3-morpholin-4-yl-propoxy)-4-(4-phenox...)
Show SMILES COc1cc2c(Nc3ccc(Oc4ccccc4)cc3)c(cnc2cc1OCCCN1CCOCC1)C#N
Show InChI InChI=1S/C30H30N4O4/c1-35-28-18-26-27(19-29(28)37-15-5-12-34-13-16-36-17-14-34)32-21-22(20-31)30(26)33-23-8-10-25(11-9-23)38-24-6-3-2-4-7-24/h2-4,6-11,18-19,21H,5,12-17H2,1H3,(H,32,33)
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n/an/a>1.00E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of Akt phosphorylation in LoVo cells

Bioorg Med Chem Lett 13: 3031-4 (2003)


BindingDB Entry DOI: 10.7270/Q2P84B8T
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM28123
PNG
(3-cyanoquinoline, 8 | 4-({3-chloro-4-[(1-methyl-1H...)
Show SMILES COc1cc2c(Nc3ccc(Sc4nccn4C)c(Cl)c3)c(cnc2cc1OCCCN1CCOCC1)C#N
Show InChI InChI=1S/C28H29ClN6O3S/c1-34-8-6-31-28(34)39-26-5-4-20(14-22(26)29)33-27-19(17-30)18-32-23-16-25(24(36-2)15-21(23)27)38-11-3-7-35-9-12-37-13-10-35/h4-6,8,14-16,18H,3,7,9-13H2,1-2H3,(H,32,33)
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n/an/a>1.00E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of MEK1 phosphorylation in LoVo cells

Bioorg Med Chem Lett 13: 3031-4 (2003)


BindingDB Entry DOI: 10.7270/Q2P84B8T
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM224338
PNG
(US10080750, Compound 15 | US9321760, 15 | US966233...)
Show SMILES CN(C)CC(N1CCN(CC1)c1ncnc(N)c1-c1ccc(F)cc1)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C25H28F4N6/c1-33(2)15-21(17-3-7-19(8-4-17)25(27,28)29)34-11-13-35(14-12-34)24-22(23(30)31-16-32-24)18-5-9-20(26)10-6-18/h3-10,16,21H,11-15H2,1-2H3,(H2,30,31,32)
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n/an/a>1.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM182321
PNG
(US9145392, 22)
Show SMILES Cn1cc(nc1C1CCN(CC1)c1ncnc(N)c1-c1cccc(F)c1)-c1ccc(F)c(c1)C(F)(F)F
Show InChI InChI=1S/C26H23F5N6/c1-36-13-21(16-5-6-20(28)19(12-16)26(29,30)31)35-24(36)15-7-9-37(10-8-15)25-22(23(32)33-14-34-25)17-3-2-4-18(27)11-17/h2-6,11-15H,7-10H2,1H3,(H2,32,33,34)
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n/an/a>1.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM182322
PNG
(US9145392, 23)
Show SMILES Cn1cc(nc1C1CCN(CC1)c1ncnc(N)c1-c1ccccc1F)-c1ccc(F)c(c1)C(F)(F)F |(-5,1.39,;-3.66,2.16,;-3.19,3.63,;-1.65,3.63,;-1.17,2.16,;-2.42,1.26,;-2.42,-.28,;-3.75,-1.05,;-3.75,-2.59,;-2.42,-3.36,;-1.08,-2.59,;-1.08,-1.05,;-2.42,-4.9,;-3.75,-5.67,;-3.75,-7.21,;-2.42,-7.98,;-1.08,-7.21,;.25,-7.98,;-1.08,-5.67,;.25,-4.9,;.25,-3.36,;1.59,-2.59,;2.92,-3.36,;2.92,-4.9,;1.59,-5.67,;1.59,-7.21,;-.56,4.72,;-.96,6.2,;.13,7.29,;1.62,6.89,;2.71,7.98,;2.11,5.34,;.93,4.32,;3.6,4.93,;5.08,4.51,;4.01,6.41,;3.18,3.44,)|
Show InChI InChI=1S/C26H23F5N6/c1-36-13-21(16-6-7-20(28)18(12-16)26(29,30)31)35-24(36)15-8-10-37(11-9-15)25-22(23(32)33-14-34-25)17-4-2-3-5-19(17)27/h2-7,12-15H,8-11H2,1H3,(H2,32,33,34)
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n/an/a>1.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM50451248
PNG
(CHEMBL2368948)
Show SMILES CCCCCCCCCCCCCCCCCCOC[C@H](COP(O)(=O)O[C@@H]1[C@H](O)C[C@@H](O)[C@H](O)[C@@H]1O)OC
Show InChI InChI=1S/C28H57O10P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-36-21-23(35-2)22-37-39(33,34)38-28-25(30)20-24(29)26(31)27(28)32/h23-32H,3-22H2,1-2H3,(H,33,34)/t23-,24-,25-,26+,27+,28-/m1/s1
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n/an/a 1.50E+3n/an/an/an/an/an/a



Georgetown University Medical Center

Curated by ChEMBL


Assay Description
Inhibition of Akt (proto-oncogenic serine/threonine) kinase

Bioorg Med Chem Lett 11: 173-6 (2001)


BindingDB Entry DOI: 10.7270/Q2765DMS
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM50451248
PNG
(CHEMBL2368948)
Show SMILES CCCCCCCCCCCCCCCCCCOC[C@H](COP(O)(=O)O[C@@H]1[C@H](O)C[C@@H](O)[C@H](O)[C@@H]1O)OC
Show InChI InChI=1S/C28H57O10P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-36-21-23(35-2)22-37-39(33,34)38-28-25(30)20-24(29)26(31)27(28)32/h23-32H,3-22H2,1-2H3,(H,33,34)/t23-,24-,25-,26+,27+,28-/m1/s1
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n/an/a 1.50E+3n/an/an/an/an/an/a



Georgetown University Medical Center

Curated by ChEMBL


Assay Description
Inhibition of Akt (proto-oncogenic serine/threonine PKB) kinase

J Med Chem 43: 3045-51 (2000)


Article DOI: 10.1021/jm000117y
BindingDB Entry DOI: 10.7270/Q2V98BTD
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM50204693
PNG
(3-(4'-hydroxy-biphenyl-4-yl)-1,4-dihydro-indeno[1,...)
Show SMILES Oc1ccc(cc1)-c1ccc(cc1)-c1n[nH]c-2c1Cc1cc(ccc-21)C(=O)NCc1ccncc1
Show InChI InChI=1S/C29H22N4O2/c34-24-8-5-20(6-9-24)19-1-3-21(4-2-19)27-26-16-23-15-22(7-10-25(23)28(26)33-32-27)29(35)31-17-18-11-13-30-14-12-18/h1-15,34H,16-17H2,(H,31,35)(H,32,33)
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n/an/a 1.58E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of AKT by radiometric assay

Bioorg Med Chem 15: 2759-67 (2007)


Article DOI: 10.1016/j.bmc.2007.01.012
BindingDB Entry DOI: 10.7270/Q2XS5V22
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM182336
PNG
(US9145392, 37)
Show SMILES Cn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C(N)=O)-c1ccc(F)c(c1)C(F)(F)F
Show InChI InChI=1S/C21H21F4N7O/c1-31-9-15(12-2-3-14(22)13(8-12)21(23,24)25)30-19(31)11-4-6-32(7-5-11)20-16(18(27)33)17(26)28-10-29-20/h2-3,8-11H,4-7H2,1H3,(H2,27,33)(H2,26,28,29)
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n/an/a 1.60E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM182309
PNG
(US9145392, 10)
Show SMILES Cn1cc(nc1C1CCN(CC1)c1ncnc(N)c1-c1ccc(F)cc1)-c1ccc(F)c(c1)C(F)(F)F
Show InChI InChI=1S/C26H23F5N6/c1-36-13-21(17-4-7-20(28)19(12-17)26(29,30)31)35-24(36)16-8-10-37(11-9-16)25-22(23(32)33-14-34-25)15-2-5-18(27)6-3-15/h2-7,12-14,16H,8-11H2,1H3,(H2,32,33,34)
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n/an/a 2.20E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Akt (unknown origin)

Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128352
BindingDB Entry DOI: 10.7270/Q2SB49H5
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM2579
PNG
((2S,3R,4R,6R)-3-methoxy-2-methyl-4-(methylamino)-2...)
Show SMILES CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r|
Show InChI InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20-,26-,28+/m1/s1
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n/an/a 4.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human AKT assessed as inhibition of substrate phosphorylation using AKTide-2T as substrate

Citation and Details

Article DOI: 10.1016/j.ejmech.2019.111875
BindingDB Entry DOI: 10.7270/Q2X92FXB
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM50204694
PNG
(3-(4'-HYDROXYBIPHENYL-4-YL)-N-(4-HYDROXYCYCLOHEXYL...)
Show SMILES O[C@H]1CC[C@@H](CC1)NC(=O)c1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)c1 |wU:4.7,wD:1.0,(19.77,-1.9,;21.02,-1.01,;22.42,-1.66,;23.69,-.77,;23.53,.76,;22.14,1.41,;20.89,.52,;24.79,1.65,;26.19,1.01,;26.33,-.53,;27.44,1.9,;27.3,3.44,;28.55,4.33,;29.95,3.7,;30.1,2.15,;31.61,1.81,;32.4,3.14,;33.83,3.77,;33.68,5.31,;32.16,5.65,;31.37,4.31,;35.16,2.99,;35.15,1.44,;36.46,.66,;37.81,1.42,;37.82,2.96,;36.49,3.74,;39.13,.64,;39.12,-.9,;40.44,-1.67,;41.78,-.91,;43.11,-1.69,;41.78,.63,;40.46,1.4,;28.85,1.26,)|
Show InChI InChI=1S/C29H27N3O3/c33-23-10-5-18(6-11-23)17-1-3-19(4-2-17)27-26-16-21-15-20(7-14-25(21)28(26)32-31-27)29(35)30-22-8-12-24(34)13-9-22/h1-7,10-11,14-15,22,24,33-34H,8-9,12-13,16H2,(H,30,35)(H,31,32)/t22-,24-
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n/an/a 4.43E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of AKT by radiometric assay

Bioorg Med Chem 15: 2759-67 (2007)


Article DOI: 10.1016/j.bmc.2007.01.012
BindingDB Entry DOI: 10.7270/Q2XS5V22
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM50472751
PNG
(CHEMBL2367874)
Show SMILES CCCCCCCCCCCCCCCCCCOC[C@H](COC(=O)O[C@H]1[C@@H](O)[C@@H](O)[C@H](O)[C@@H](CO)[C@H]1O)OC
Show InChI InChI=1S/C30H58O10/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-38-21-23(37-2)22-39-30(36)40-29-26(33)24(20-31)25(32)27(34)28(29)35/h23-29,31-35H,3-22H2,1-2H3/t23-,24-,25-,26-,27+,28+,29-/m1/s1
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n/an/a 5.00E+3n/an/an/an/an/an/a



Georgetown University Medical Center

Curated by ChEMBL


Assay Description
Inhibition of Akt (proto-oncogenic serine/threonine PKB) kinase

J Med Chem 43: 3045-51 (2000)


Article DOI: 10.1021/jm000117y
BindingDB Entry DOI: 10.7270/Q2V98BTD
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM50189603
PNG
(CHEMBL377734 | N-cyclopropyl-2,4-difluoro-5-((2-(p...)
Show SMILES Fc1cc(F)c(cc1NCc1cnc(Nc2ccccn2)s1)C(=O)NC1CC1
Show InChI InChI=1S/C19H17F2N5OS/c20-14-8-15(21)16(7-13(14)18(27)25-11-4-5-11)23-9-12-10-24-19(28-12)26-17-3-1-2-6-22-17/h1-3,6-8,10-11,23H,4-5,9H2,(H,25,27)(H,22,24,26)
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n/an/a>5.00E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of AKT

J Med Chem 49: 3766-9 (2006)


Article DOI: 10.1021/jm060347y
BindingDB Entry DOI: 10.7270/Q2PG1RBM
More data for this
Ligand-Target Pair
RAC-alpha/RAC-beta/RAC-gamma serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM50091042
PNG
(CHEMBL2368953 | Carbonic acid (R)-2-methoxy-3-octa...)
Show SMILES CCCCCCCCCCCCCCCCCCOC[C@H](COC(=O)O[C@H]1[C@@H](O)[C@@H](O)[C@H](O)[C@H](CO)[C@H]1O)OC
Show InChI InChI=1S/C30H58O10/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-38-21-23(37-2)22-39-30(36)40-29-26(33)24(20-31)25(32)27(34)28(29)35/h23-29,31-35H,3-22H2,1-2H3/t23-,24+,25-,26-,27+,28+,29-/m1/s1
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n/an/a 5.00E+3n/an/an/an/an/an/a



Georgetown University Medical Center

Curated by ChEMBL


Assay Description
Inhibition of Akt (proto-oncogenic serine/threonine) kinase

Bioorg Med Chem Lett 11: 173-6 (2001)


BindingDB Entry DOI: 10.7270/Q2765DMS
More data for this
Ligand-Target Pair
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