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Compile Data Set for Download or QSAR

Found 510 hits Enz. Inhib. hit(s) with all data for entry = 10114   
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 pim-3


(Homo sapiens (Human))
BDBM376809
PNG
(N-(4-((1R,3S,5S)-3-Amino-5-methylcyclohexyl)pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)C1CCCC1C#N |r|
Show InChI InChI=1S/C29H33FN6O/c1-17-10-19(12-20(32)11-17)22-8-9-33-16-26(22)35-29(37)23-6-7-25(30)24-13-21(15-34-28(23)24)36(2)27-5-3-4-18(27)14-31/h6-9,13,15-20,27H,3-5,10-12,32H2,1-2H3,(H,35,37)/t17-,18?,19+,20-,27?/m0/s1
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TBA

Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM376810
PNG
(N-(4-((1R,3S,5S)-3-Amino-5-methylcyclohexyl)pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)c1ccc(C)nc1C |r|
Show InChI InChI=1S/C30H33FN6O/c1-17-11-20(13-21(32)12-17)23-9-10-33-16-27(23)36-30(38)24-6-7-26(31)25-14-22(15-34-29(24)25)37(4)28-8-5-18(2)35-19(28)3/h5-10,14-17,20-21H,11-13,32H2,1-4H3,(H,36,38)/t17-,20+,21-/m0/s1
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TBA

Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-3


(Homo sapiens (Human))
BDBM376810
PNG
(N-(4-((1R,3S,5S)-3-Amino-5-methylcyclohexyl)pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)c1ccc(C)nc1C |r|
Show InChI InChI=1S/C30H33FN6O/c1-17-11-20(13-21(32)12-17)23-9-10-33-16-27(23)36-30(38)24-6-7-26(31)25-14-22(15-34-29(24)25)37(4)28-8-5-18(2)35-19(28)3/h5-10,14-17,20-21H,11-13,32H2,1-4H3,(H,36,38)/t17-,20+,21-/m0/s1
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TBA

Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM376811
PNG
(N-(4-((1R,3S,5S)-3-Amino-5-methylcyclohexyl)pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)c1ncccc1F |r|
Show InChI InChI=1S/C28H28F2N6O/c1-16-10-17(12-18(31)11-16)20-7-9-32-15-25(20)35-28(37)21-5-6-23(29)22-13-19(14-34-26(21)22)36(2)27-24(30)4-3-8-33-27/h3-9,13-18H,10-12,31H2,1-2H3,(H,35,37)/t16-,17+,18-/m0/s1
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TBA

Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-3


(Homo sapiens (Human))
BDBM376811
PNG
(N-(4-((1R,3S,5S)-3-Amino-5-methylcyclohexyl)pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)c1ncccc1F |r|
Show InChI InChI=1S/C28H28F2N6O/c1-16-10-17(12-18(31)11-16)20-7-9-32-15-25(20)35-28(37)21-5-6-23(29)22-13-19(14-34-26(21)22)36(2)27-24(30)4-3-8-33-27/h3-9,13-18H,10-12,31H2,1-2H3,(H,35,37)/t16-,17+,18-/m0/s1
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TBA

Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM376812
PNG
(N-(4-((1R,3S,5S)-3-Amino-5-methylcyclohexyl)pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)c1cnccc1C(F)(F)F |r|
Show InChI InChI=1S/C29H28F4N6O/c1-16-9-17(11-18(34)10-16)20-5-7-35-14-25(20)38-28(40)21-3-4-24(30)22-12-19(13-37-27(21)22)39(2)26-15-36-8-6-23(26)29(31,32)33/h3-8,12-18H,9-11,34H2,1-2H3,(H,38,40)/t16-,17+,18-/m0/s1
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TBA

Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-3


(Homo sapiens (Human))
BDBM376812
PNG
(N-(4-((1R,3S,5S)-3-Amino-5-methylcyclohexyl)pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)c1cnccc1C(F)(F)F |r|
Show InChI InChI=1S/C29H28F4N6O/c1-16-9-17(11-18(34)10-16)20-5-7-35-14-25(20)38-28(40)21-3-4-24(30)22-12-19(13-37-27(21)22)39(2)26-15-36-8-6-23(26)29(31,32)33/h3-8,12-18H,9-11,34H2,1-2H3,(H,38,40)/t16-,17+,18-/m0/s1
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TBA

Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM376813
PNG
(N-(4-((1R,3S,5S)-3-Amino-5-methylcyclohexyl)pyridi...)
Show SMILES COc1ccc(N(C)c2cnc3c(ccc(F)c3c2)C(=O)Nc2cnccc2[C@@H]2C[C@H](C)C[C@H](N)C2)c(C)n1 |r|
Show InChI InChI=1S/C30H33FN6O2/c1-17-11-19(13-20(32)12-17)22-9-10-33-16-26(22)36-30(38)23-5-6-25(31)24-14-21(15-34-29(23)24)37(3)27-7-8-28(39-4)35-18(27)2/h5-10,14-17,19-20H,11-13,32H2,1-4H3,(H,36,38)/t17-,19+,20-/m0/s1
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TBA

Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-3


(Homo sapiens (Human))
BDBM376813
PNG
(N-(4-((1R,3S,5S)-3-Amino-5-methylcyclohexyl)pyridi...)
Show SMILES COc1ccc(N(C)c2cnc3c(ccc(F)c3c2)C(=O)Nc2cnccc2[C@@H]2C[C@H](C)C[C@H](N)C2)c(C)n1 |r|
Show InChI InChI=1S/C30H33FN6O2/c1-17-11-19(13-20(32)12-17)22-9-10-33-16-26(22)36-30(38)23-5-6-25(31)24-14-21(15-34-29(23)24)37(3)27-7-8-28(39-4)35-18(27)2/h5-10,14-17,19-20H,11-13,32H2,1-4H3,(H,36,38)/t17-,19+,20-/m0/s1
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TBA

Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM376814
PNG
(N-(4-((1R,3S,5S)-3-Amino-5-methylcyclohexyl)pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)c1ccncc1F |r|
Show InChI InChI=1S/C28H28F2N6O/c1-16-9-17(11-18(31)10-16)20-5-7-33-15-25(20)35-28(37)21-3-4-23(29)22-12-19(13-34-27(21)22)36(2)26-6-8-32-14-24(26)30/h3-8,12-18H,9-11,31H2,1-2H3,(H,35,37)/t16-,17+,18-/m0/s1
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TBA

Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-3


(Homo sapiens (Human))
BDBM376814
PNG
(N-(4-((1R,3S,5S)-3-Amino-5-methylcyclohexyl)pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)c1ccncc1F |r|
Show InChI InChI=1S/C28H28F2N6O/c1-16-9-17(11-18(31)10-16)20-5-7-33-15-25(20)35-28(37)21-3-4-23(29)22-12-19(13-34-27(21)22)36(2)26-6-8-32-14-24(26)30/h3-8,12-18H,9-11,31H2,1-2H3,(H,35,37)/t16-,17+,18-/m0/s1
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TBA

Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM376815
PNG
(N-(4-((1R,3S,5S)-3-Amino-5-methylcyclohexyl)pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)c1cnccc1C |r|
Show InChI InChI=1S/C29H31FN6O/c1-17-10-19(12-20(31)11-17)22-7-9-32-15-26(22)35-29(37)23-4-5-25(30)24-13-21(14-34-28(23)24)36(3)27-16-33-8-6-18(27)2/h4-9,13-17,19-20H,10-12,31H2,1-3H3,(H,35,37)/t17-,19+,20-/m0/s1
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TBA

Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM376687
PNG
(N-(4-((1R,3S,5S)-3-Amino-5-methylcyclohexyl)pyridi...)
Show SMILES CCN(C)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
Show InChI InChI=1S/C25H30FN5O/c1-4-31(3)18-12-21-22(26)6-5-20(24(21)29-13-18)25(32)30-23-14-28-8-7-19(23)16-9-15(2)10-17(27)11-16/h5-8,12-17H,4,9-11,27H2,1-3H3,(H,30,32)/t15-,16+,17-/m0/s1
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TBA

Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-3


(Homo sapiens (Human))
BDBM376687
PNG
(N-(4-((1R,3S,5S)-3-Amino-5-methylcyclohexyl)pyridi...)
Show SMILES CCN(C)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
Show InChI InChI=1S/C25H30FN5O/c1-4-31(3)18-12-21-22(26)6-5-20(24(21)29-13-18)25(32)30-23-14-28-8-7-19(23)16-9-15(2)10-17(27)11-16/h5-8,12-17H,4,9-11,27H2,1-3H3,(H,30,32)/t15-,16+,17-/m0/s1
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TBA

Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM376688
PNG
(N-{4-[(1R,3S,5S)-3-Amino-5-methylcyclohexyl]pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)CC(F)(F)F |r|
Show InChI InChI=1S/C25H27F4N5O/c1-14-7-15(9-16(30)8-14)18-5-6-31-12-22(18)33-24(35)19-3-4-21(26)20-10-17(11-32-23(19)20)34(2)13-25(27,28)29/h3-6,10-12,14-16H,7-9,13,30H2,1-2H3,(H,33,35)/t14-,15+,16-/m0/s1
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TBA

Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-3


(Homo sapiens (Human))
BDBM376688
PNG
(N-{4-[(1R,3S,5S)-3-Amino-5-methylcyclohexyl]pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)CC(F)(F)F |r|
Show InChI InChI=1S/C25H27F4N5O/c1-14-7-15(9-16(30)8-14)18-5-6-31-12-22(18)33-24(35)19-3-4-21(26)20-10-17(11-32-23(19)20)34(2)13-25(27,28)29/h3-6,10-12,14-16H,7-9,13,30H2,1-2H3,(H,33,35)/t14-,15+,16-/m0/s1
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TBA

Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM376689
PNG
(N-{4-[(1R,3S,5S)-3-Amino-5-methylcyclohexyl]pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)CCF |r|
Show InChI InChI=1S/C25H29F2N5O/c1-15-9-16(11-17(28)10-15)19-5-7-29-14-23(19)31-25(33)20-3-4-22(27)21-12-18(13-30-24(20)21)32(2)8-6-26/h3-5,7,12-17H,6,8-11,28H2,1-2H3,(H,31,33)/t15-,16+,17-/m0/s1
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TBA

Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-3


(Homo sapiens (Human))
BDBM376689
PNG
(N-{4-[(1R,3S,5S)-3-Amino-5-methylcyclohexyl]pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)CCF |r|
Show InChI InChI=1S/C25H29F2N5O/c1-15-9-16(11-17(28)10-15)19-5-7-29-14-23(19)31-25(33)20-3-4-22(27)21-12-18(13-30-24(20)21)32(2)8-6-26/h3-5,7,12-17H,6,8-11,28H2,1-2H3,(H,31,33)/t15-,16+,17-/m0/s1
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Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM376690
PNG
(N-{4-[(1R,3S,5S)-3-Amino-5-methylcyclohexyl]pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)C1CCOC1 |r|
Show InChI InChI=1S/C27H32FN5O2/c1-16-9-17(11-18(29)10-16)21-5-7-30-14-25(21)32-27(34)22-3-4-24(28)23-12-20(13-31-26(22)23)33(2)19-6-8-35-15-19/h3-5,7,12-14,16-19H,6,8-11,15,29H2,1-2H3,(H,32,34)/t16-,17+,18-,19?/m0/s1
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Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-3


(Homo sapiens (Human))
BDBM376690
PNG
(N-{4-[(1R,3S,5S)-3-Amino-5-methylcyclohexyl]pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)C1CCOC1 |r|
Show InChI InChI=1S/C27H32FN5O2/c1-16-9-17(11-18(29)10-16)21-5-7-30-14-25(21)32-27(34)22-3-4-24(28)23-12-20(13-31-26(22)23)33(2)19-6-8-35-15-19/h3-5,7,12-14,16-19H,6,8-11,15,29H2,1-2H3,(H,32,34)/t16-,17+,18-,19?/m0/s1
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Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM376691
PNG
(N-{4-[(1R,3S,5S)-3-Amino-5-methylcyclohexyl]pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)C1CCC1 |r|
Show InChI InChI=1S/C27H32FN5O/c1-16-10-17(12-18(29)11-16)21-8-9-30-15-25(21)32-27(34)22-6-7-24(28)23-13-20(14-31-26(22)23)33(2)19-4-3-5-19/h6-9,13-19H,3-5,10-12,29H2,1-2H3,(H,32,34)/t16-,17+,18-/m0/s1
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Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-3


(Homo sapiens (Human))
BDBM376691
PNG
(N-{4-[(1R,3S,5S)-3-Amino-5-methylcyclohexyl]pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)C1CCC1 |r|
Show InChI InChI=1S/C27H32FN5O/c1-16-10-17(12-18(29)11-16)21-8-9-30-15-25(21)32-27(34)22-6-7-24(28)23-13-20(14-31-26(22)23)33(2)19-4-3-5-19/h6-9,13-19H,3-5,10-12,29H2,1-2H3,(H,32,34)/t16-,17+,18-/m0/s1
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Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM376692
PNG
(N-{4-[(1R,3S,5S)-3-Amino-5-methylcyclohexyl]pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)C |r|
Show InChI InChI=1S/C24H28FN5O/c1-14-8-15(10-16(26)9-14)18-6-7-27-13-22(18)29-24(31)19-4-5-21(25)20-11-17(30(2)3)12-28-23(19)20/h4-7,11-16H,8-10,26H2,1-3H3,(H,29,31)/t14-,15+,16-/m0/s1
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Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-3


(Homo sapiens (Human))
BDBM376692
PNG
(N-{4-[(1R,3S,5S)-3-Amino-5-methylcyclohexyl]pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)C |r|
Show InChI InChI=1S/C24H28FN5O/c1-14-8-15(10-16(26)9-14)18-6-7-27-13-22(18)29-24(31)19-4-5-21(25)20-11-17(30(2)3)12-28-23(19)20/h4-7,11-16H,8-10,26H2,1-3H3,(H,29,31)/t14-,15+,16-/m0/s1
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Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM376693
PNG
(N-{4-[(1R,3S,5S)-3-Amino-5-methylcyclohexyl]pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(NCCF)cnc12 |r|
Show InChI InChI=1S/C24H27F2N5O/c1-14-8-15(10-16(27)9-14)18-4-6-28-13-22(18)31-24(32)19-2-3-21(26)20-11-17(29-7-5-25)12-30-23(19)20/h2-4,6,11-16,29H,5,7-10,27H2,1H3,(H,31,32)/t14-,15+,16-/m0/s1
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Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-3


(Homo sapiens (Human))
BDBM376693
PNG
(N-{4-[(1R,3S,5S)-3-Amino-5-methylcyclohexyl]pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(NCCF)cnc12 |r|
Show InChI InChI=1S/C24H27F2N5O/c1-14-8-15(10-16(27)9-14)18-4-6-28-13-22(18)31-24(32)19-2-3-21(26)20-11-17(29-7-5-25)12-30-23(19)20/h2-4,6,11-16,29H,5,7-10,27H2,1H3,(H,31,32)/t14-,15+,16-/m0/s1
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Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM376694
PNG
(N-{4-[(1R,3S,5S)-3-Amino-5-methylcyclohexyl]pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(NCC(F)F)cnc12 |r|
Show InChI InChI=1S/C24H26F3N5O/c1-13-6-14(8-15(28)7-13)17-4-5-29-11-21(17)32-24(33)18-2-3-20(25)19-9-16(10-31-23(18)19)30-12-22(26)27/h2-5,9-11,13-15,22,30H,6-8,12,28H2,1H3,(H,32,33)/t13-,14+,15-/m0/s1
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Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-3


(Homo sapiens (Human))
BDBM376694
PNG
(N-{4-[(1R,3S,5S)-3-Amino-5-methylcyclohexyl]pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(NCC(F)F)cnc12 |r|
Show InChI InChI=1S/C24H26F3N5O/c1-13-6-14(8-15(28)7-13)17-4-5-29-11-21(17)32-24(33)18-2-3-20(25)19-9-16(10-31-23(18)19)30-12-22(26)27/h2-5,9-11,13-15,22,30H,6-8,12,28H2,1H3,(H,32,33)/t13-,14+,15-/m0/s1
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Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM376695
PNG
(N-{4-[(1R,3S,5S)-3-Amino-5-methylcyclohexyl]pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCCC(F)(F)C1 |r|
Show InChI InChI=1S/C27H30F3N5O/c1-16-9-17(11-18(31)10-16)20-5-7-32-14-24(20)34-26(36)21-3-4-23(28)22-12-19(13-33-25(21)22)35-8-2-6-27(29,30)15-35/h3-5,7,12-14,16-18H,2,6,8-11,15,31H2,1H3,(H,34,36)/t16-,17+,18-/m0/s1
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Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-3


(Homo sapiens (Human))
BDBM376695
PNG
(N-{4-[(1R,3S,5S)-3-Amino-5-methylcyclohexyl]pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCCC(F)(F)C1 |r|
Show InChI InChI=1S/C27H30F3N5O/c1-16-9-17(11-18(31)10-16)20-5-7-32-14-24(20)34-26(36)21-3-4-23(28)22-12-19(13-33-25(21)22)35-8-2-6-27(29,30)15-35/h3-5,7,12-14,16-18H,2,6,8-11,15,31H2,1H3,(H,34,36)/t16-,17+,18-/m0/s1
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Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM376696
PNG
(N-{4-[(1R,3S,5S)-3-Amino-5-methylcyclohexyl]pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CC[C@H](O)[C@@H](F)C1 |r|
Show InChI InChI=1S/C27H31F2N5O2/c1-15-8-16(10-17(30)9-15)19-4-6-31-13-24(19)33-27(36)20-2-3-22(28)21-11-18(12-32-26(20)21)34-7-5-25(35)23(29)14-34/h2-4,6,11-13,15-17,23,25,35H,5,7-10,14,30H2,1H3,(H,33,36)/t15-,16+,17-,23-,25-/m0/s1
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Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-3


(Homo sapiens (Human))
BDBM376696
PNG
(N-{4-[(1R,3S,5S)-3-Amino-5-methylcyclohexyl]pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CC[C@H](O)[C@@H](F)C1 |r|
Show InChI InChI=1S/C27H31F2N5O2/c1-15-8-16(10-17(30)9-15)19-4-6-31-13-24(19)33-27(36)20-2-3-22(28)21-11-18(12-32-26(20)21)34-7-5-25(35)23(29)14-34/h2-4,6,11-13,15-17,23,25,35H,5,7-10,14,30H2,1H3,(H,33,36)/t15-,16+,17-,23-,25-/m0/s1
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Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM376697
PNG
(N-{4-[(1R,3S,5S)-3-Amino-5-methylcyclohexyl]pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCN(C)CC1 |r|
Show InChI InChI=1S/C27H33FN6O/c1-17-11-18(13-19(29)12-17)21-5-6-30-16-25(21)32-27(35)22-3-4-24(28)23-14-20(15-31-26(22)23)34-9-7-33(2)8-10-34/h3-6,14-19H,7-13,29H2,1-2H3,(H,32,35)/t17-,18+,19-/m0/s1
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Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-3


(Homo sapiens (Human))
BDBM376697
PNG
(N-{4-[(1R,3S,5S)-3-Amino-5-methylcyclohexyl]pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCN(C)CC1 |r|
Show InChI InChI=1S/C27H33FN6O/c1-17-11-18(13-19(29)12-17)21-5-6-30-16-25(21)32-27(35)22-3-4-24(28)23-14-20(15-31-26(22)23)34-9-7-33(2)8-10-34/h3-6,14-19H,7-13,29H2,1-2H3,(H,32,35)/t17-,18+,19-/m0/s1
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Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM376698
PNG
(N-{4-[(1R,3S,5S)-3-Amino-5-methylcyclohexyl]pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)C1CCOCC1 |r|
Show InChI InChI=1S/C27H31FN4O2/c1-16-10-18(12-20(29)11-16)21-4-7-30-15-25(21)32-27(33)22-2-3-24(28)23-13-19(14-31-26(22)23)17-5-8-34-9-6-17/h2-4,7,13-18,20H,5-6,8-12,29H2,1H3,(H,32,33)/t16-,18+,20-/m0/s1
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Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-3


(Homo sapiens (Human))
BDBM376698
PNG
(N-{4-[(1R,3S,5S)-3-Amino-5-methylcyclohexyl]pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)C1CCOCC1 |r|
Show InChI InChI=1S/C27H31FN4O2/c1-16-10-18(12-20(29)11-16)21-4-7-30-15-25(21)32-27(33)22-2-3-24(28)23-13-19(14-31-26(22)23)17-5-8-34-9-6-17/h2-4,7,13-18,20H,5-6,8-12,29H2,1H3,(H,32,33)/t16-,18+,20-/m0/s1
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Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM376699
PNG
(N-(4-((1R,3S,5S)-3-Amino-5-methylcyclohexyl)pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCOC[C@H]1C |r|
Show InChI InChI=1S/C27H32FN5O2/c1-16-9-18(11-19(29)10-16)21-5-6-30-14-25(21)32-27(34)22-3-4-24(28)23-12-20(13-31-26(22)23)33-7-8-35-15-17(33)2/h3-6,12-14,16-19H,7-11,15,29H2,1-2H3,(H,32,34)/t16-,17+,18+,19-/m0/s1
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Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-3


(Homo sapiens (Human))
BDBM376699
PNG
(N-(4-((1R,3S,5S)-3-Amino-5-methylcyclohexyl)pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCOC[C@H]1C |r|
Show InChI InChI=1S/C27H32FN5O2/c1-16-9-18(11-19(29)10-16)21-5-6-30-14-25(21)32-27(34)22-3-4-24(28)23-12-20(13-31-26(22)23)33-7-8-35-15-17(33)2/h3-6,12-14,16-19H,7-11,15,29H2,1-2H3,(H,32,34)/t16-,17+,18+,19-/m0/s1
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Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM376700
PNG
(N-(4-((1R,3S,5S)-3-Amino-5-methylcyclohexyl)pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCOC[C@@H]1C |r|
Show InChI InChI=1S/C27H32FN5O2/c1-16-9-18(11-19(29)10-16)21-5-6-30-14-25(21)32-27(34)22-3-4-24(28)23-12-20(13-31-26(22)23)33-7-8-35-15-17(33)2/h3-6,12-14,16-19H,7-11,15,29H2,1-2H3,(H,32,34)/t16-,17-,18+,19-/m0/s1
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Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-3


(Homo sapiens (Human))
BDBM376700
PNG
(N-(4-((1R,3S,5S)-3-Amino-5-methylcyclohexyl)pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCOC[C@@H]1C |r|
Show InChI InChI=1S/C27H32FN5O2/c1-16-9-18(11-19(29)10-16)21-5-6-30-14-25(21)32-27(34)22-3-4-24(28)23-12-20(13-31-26(22)23)33-7-8-35-15-17(33)2/h3-6,12-14,16-19H,7-11,15,29H2,1-2H3,(H,32,34)/t16-,17-,18+,19-/m0/s1
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Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM376701
PNG
(N-(4-((1R,3S,5S)-3-Amino-5-methylcyclohexyl)pyridi...)
Show SMILES C[C@@H]1CCCN1c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
Show InChI InChI=1S/C27H32FN5O/c1-16-10-18(12-19(29)11-16)21-7-8-30-15-25(21)32-27(34)22-5-6-24(28)23-13-20(14-31-26(22)23)33-9-3-4-17(33)2/h5-8,13-19H,3-4,9-12,29H2,1-2H3,(H,32,34)/t16-,17+,18+,19-/m0/s1
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Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-3


(Homo sapiens (Human))
BDBM376701
PNG
(N-(4-((1R,3S,5S)-3-Amino-5-methylcyclohexyl)pyridi...)
Show SMILES C[C@@H]1CCCN1c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
Show InChI InChI=1S/C27H32FN5O/c1-16-10-18(12-19(29)11-16)21-7-8-30-15-25(21)32-27(34)22-5-6-24(28)23-13-20(14-31-26(22)23)33-9-3-4-17(33)2/h5-8,13-19H,3-4,9-12,29H2,1-2H3,(H,32,34)/t16-,17+,18+,19-/m0/s1
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Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM376702
PNG
(N-(4-((1R,3S,5S)-3-Amino-5-methylcyclohexyl)pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CC(C)OCC1C |r|
Show InChI InChI=1S/C28H34FN5O2/c1-16-8-19(10-20(30)9-16)22-6-7-31-13-26(22)33-28(35)23-4-5-25(29)24-11-21(12-32-27(23)24)34-14-18(3)36-15-17(34)2/h4-7,11-13,16-20H,8-10,14-15,30H2,1-3H3,(H,33,35)/t16-,17?,18?,19+,20-/m0/s1
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Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM376703
PNG
(N-(4-((1R,3S,5S)-3-Amino-5-methylcyclohexyl)pyridi...)
Show SMILES CC1CCC(C)N1c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
Show InChI InChI=1S/C28H34FN5O/c1-16-10-19(12-20(30)11-16)22-8-9-31-15-26(22)33-28(35)23-6-7-25(29)24-13-21(14-32-27(23)24)34-17(2)4-5-18(34)3/h6-9,13-20H,4-5,10-12,30H2,1-3H3,(H,33,35)/t16-,17?,18?,19+,20-/m0/s1
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Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM376704
PNG
(N-(4-((1R,3S,5S)-3-Amino-5-methylcyclohexyl)pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CC(C)OC(C)C1 |r|
Show InChI InChI=1S/C28H34FN5O2/c1-16-8-19(10-20(30)9-16)22-6-7-31-13-26(22)33-28(35)23-4-5-25(29)24-11-21(12-32-27(23)24)34-14-17(2)36-18(3)15-34/h4-7,11-13,16-20H,8-10,14-15,30H2,1-3H3,(H,33,35)/t16-,17?,18?,19+,20-/m0/s1
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Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM376705
PNG
(N-(4-((1R,3S,5S)-3-Amino-5-methylcyclohexyl)pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCO[C@@H](C)C1 |r|
Show InChI InChI=1S/C27H32FN5O2/c1-16-9-18(11-19(29)10-16)21-5-6-30-14-25(21)32-27(34)22-3-4-24(28)23-12-20(13-31-26(22)23)33-7-8-35-17(2)15-33/h3-6,12-14,16-19H,7-11,15,29H2,1-2H3,(H,32,34)/t16-,17-,18+,19-/m0/s1
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Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM376706
PNG
(N-(4-((1R,3S,5S)-3-Amino-5-methylcyclohexyl)pyridi...)
Show SMILES C[C@H]1CCCN1c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
Show InChI InChI=1S/C27H32FN5O/c1-16-10-18(12-19(29)11-16)21-7-8-30-15-25(21)32-27(34)22-5-6-24(28)23-13-20(14-31-26(22)23)33-9-3-4-17(33)2/h5-8,13-19H,3-4,9-12,29H2,1-2H3,(H,32,34)/t16-,17-,18+,19-/m0/s1
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Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM376707
PNG
(N-(4-((1R,3S,5S)-3-Amino-5-methylcyclohexyl)pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCC(F)(F)CC1 |r|
Show InChI InChI=1S/C27H30F3N5O/c1-16-10-17(12-18(31)11-16)20-4-7-32-15-24(20)34-26(36)21-2-3-23(28)22-13-19(14-33-25(21)22)35-8-5-27(29,30)6-9-35/h2-4,7,13-18H,5-6,8-12,31H2,1H3,(H,34,36)/t16-,17+,18-/m0/s1
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Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-3


(Homo sapiens (Human))
BDBM376707
PNG
(N-(4-((1R,3S,5S)-3-Amino-5-methylcyclohexyl)pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCC(F)(F)CC1 |r|
Show InChI InChI=1S/C27H30F3N5O/c1-16-10-17(12-18(31)11-16)20-4-7-32-15-24(20)34-26(36)21-2-3-23(28)22-13-19(14-33-25(21)22)35-8-5-27(29,30)6-9-35/h2-4,7,13-18H,5-6,8-12,31H2,1H3,(H,34,36)/t16-,17+,18-/m0/s1
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Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-1


(Homo sapiens (Human))
BDBM376709
PNG
(N-(4-((1R,3S,5S)-3-Amino-5-methylcyclohexyl)pyridi...)
Show SMILES C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)CC(F)F |r|
Show InChI InChI=1S/C25H28F3N5O/c1-14-7-15(9-16(29)8-14)18-5-6-30-12-22(18)32-25(34)19-3-4-21(26)20-10-17(11-31-24(19)20)33(2)13-23(27)28/h3-6,10-12,14-16,23H,7-9,13,29H2,1-2H3,(H,32,34)/t14-,15+,16-/m0/s1
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Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8GZM
More data for this
Ligand-Target Pair
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