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8 similar compounds to monomer 167998

Compile data set for download or QSAR
Wt: 417.4
BDBM167995
Wt: 403.4
BDBM167996
Wt: 431.4
BDBM167997
Wt: 445.4
BDBM167999
Wt: 473.5
BDBM168000
Wt: 459.5
BDBM168001
Wt: 445.4
BDBM168002
Wt: 473.5
BDBM168003

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 167995,167996,167997,167999,168000,168001,168002,168003   
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
Ribosomal protein S6 kinase alpha-3


(Homo sapiens (Human))
BDBM167995
PNG
(US9073926, 29)
Show SMILES CC(C)n1ncc2cc(NC(=O)c3ccc4cc5C(=O)NCCC(C)n5c4n3)cnc12
Show InChI InChI=1S/C22H23N7O2/c1-12(2)29-19-15(10-25-29)8-16(11-24-19)26-21(30)17-5-4-14-9-18-22(31)23-7-6-13(3)28(18)20(14)27-17/h4-5,8-13H,6-7H2,1-3H3,(H,23,31)(H,26,30)
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n/an/a 2.10n/an/an/an/a7.5n/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Human RSK2 protein, purchased from Invitrogen, is used to measure kinase activity utilizing Kinase Glo Plus (Promega) a homogeneous assay technology,...


US Patent US9073926 (2015)


BindingDB Entry DOI: 10.7270/Q2BP01J6
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-3


(Homo sapiens (Human))
BDBM167996
PNG
(US9073926, 30)
Show SMILES CC(C)n1ncc2cc(NC(=O)c3ccc4cc5C(=O)NCCCn5c4n3)cnc12
Show InChI InChI=1S/C21H21N7O2/c1-12(2)28-18-14(10-24-28)8-15(11-23-18)25-20(29)16-5-4-13-9-17-21(30)22-6-3-7-27(17)19(13)26-16/h4-5,8-12H,3,6-7H2,1-2H3,(H,22,30)(H,25,29)
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n/an/a 25n/an/an/an/a7.5n/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Human RSK2 protein, purchased from Invitrogen, is used to measure kinase activity utilizing Kinase Glo Plus (Promega) a homogeneous assay technology,...


US Patent US9073926 (2015)


BindingDB Entry DOI: 10.7270/Q2BP01J6
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-3


(Homo sapiens (Human))
BDBM167997
PNG
(US9073926, 31)
Show SMILES CC(C)n1ncc2cc(NC(=O)c3ccc4cc5C(=O)NCC(C)(C)Cn5c4n3)cnc12
Show InChI InChI=1S/C23H25N7O2/c1-13(2)30-19-15(9-26-30)7-16(10-24-19)27-21(31)17-6-5-14-8-18-22(32)25-11-23(3,4)12-29(18)20(14)28-17/h5-10,13H,11-12H2,1-4H3,(H,25,32)(H,27,31)
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n/an/a 105n/an/an/an/a7.5n/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Human RSK2 protein, purchased from Invitrogen, is used to measure kinase activity utilizing Kinase Glo Plus (Promega) a homogeneous assay technology,...


US Patent US9073926 (2015)


BindingDB Entry DOI: 10.7270/Q2BP01J6
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-3


(Homo sapiens (Human))
BDBM168003
PNG
(US9073926, 37)
Show SMILES CC1(C)CNC(=O)c2cc3ccc(nc3n2C1)C(=O)Nc1cnc2n(CC3CCOC3)ncc2c1
Show InChI InChI=1S/C25H27N7O3/c1-25(2)13-27-24(34)20-8-16-3-4-19(30-22(16)31(20)14-25)23(33)29-18-7-17-9-28-32(21(17)26-10-18)11-15-5-6-35-12-15/h3-4,7-10,15H,5-6,11-14H2,1-2H3,(H,27,34)(H,29,33)
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n/an/a 25n/an/an/an/a7.5n/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Human RSK2 protein, purchased from Invitrogen, is used to measure kinase activity utilizing Kinase Glo Plus (Promega) a homogeneous assay technology,...


US Patent US9073926 (2015)


BindingDB Entry DOI: 10.7270/Q2BP01J6
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-3


(Homo sapiens (Human))
BDBM168000
PNG
(US9073926, 34)
Show SMILES CC1(C)CNC(=O)c2cc3ccc(nc3n2C1)C(=O)Nc1cnc2n(ncc2c1)C1CCOCC1
Show InChI InChI=1S/C25H27N7O3/c1-25(2)13-27-24(34)20-10-15-3-4-19(30-22(15)31(20)14-25)23(33)29-17-9-16-11-28-32(21(16)26-12-17)18-5-7-35-8-6-18/h3-4,9-12,18H,5-8,13-14H2,1-2H3,(H,27,34)(H,29,33)
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n/an/a 62n/an/an/an/a7.5n/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Human RSK2 protein, purchased from Invitrogen, is used to measure kinase activity utilizing Kinase Glo Plus (Promega) a homogeneous assay technology,...


US Patent US9073926 (2015)


BindingDB Entry DOI: 10.7270/Q2BP01J6
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-3


(Homo sapiens (Human))
BDBM168001
PNG
(US9073926, 35)
Show SMILES CC1CCNC(=O)c2cc3ccc(nc3n12)C(=O)Nc1cnc2n(CC3CCOC3)ncc2c1
Show InChI InChI=1S/C24H25N7O3/c1-14-4-6-25-24(33)20-9-16-2-3-19(29-22(16)31(14)20)23(32)28-18-8-17-10-27-30(21(17)26-11-18)12-15-5-7-34-13-15/h2-3,8-11,14-15H,4-7,12-13H2,1H3,(H,25,33)(H,28,32)
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n/an/a 1.60n/an/an/an/a7.5n/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Human RSK2 protein, purchased from Invitrogen, is used to measure kinase activity utilizing Kinase Glo Plus (Promega) a homogeneous assay technology,...


US Patent US9073926 (2015)


BindingDB Entry DOI: 10.7270/Q2BP01J6
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-3


(Homo sapiens (Human))
BDBM168002
PNG
(US9073926, 36)
Show SMILES O=C(Nc1cnc2n(CC3CCOC3)ncc2c1)c1ccc2cc3C(=O)NCCCn3c2n1
Show InChI InChI=1S/C23H23N7O3/c31-22(18-3-2-15-9-19-23(32)24-5-1-6-29(19)21(15)28-18)27-17-8-16-10-26-30(20(16)25-11-17)12-14-4-7-33-13-14/h2-3,8-11,14H,1,4-7,12-13H2,(H,24,32)(H,27,31)
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n/an/a 13n/an/an/an/a7.5n/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Human RSK2 protein, purchased from Invitrogen, is used to measure kinase activity utilizing Kinase Glo Plus (Promega) a homogeneous assay technology,...


US Patent US9073926 (2015)


BindingDB Entry DOI: 10.7270/Q2BP01J6
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-3


(Homo sapiens (Human))
BDBM167999
PNG
(US9073926, 33)
Show SMILES O=C(Nc1cnc2n(ncc2c1)C1CCOCC1)c1ccc2cc3C(=O)NCCCn3c2n1
Show InChI InChI=1S/C23H23N7O3/c31-22(18-3-2-14-11-19-23(32)24-6-1-7-29(19)21(14)28-18)27-16-10-15-12-26-30(20(15)25-13-16)17-4-8-33-9-5-17/h2-3,10-13,17H,1,4-9H2,(H,24,32)(H,27,31)
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n/an/a 20n/an/an/an/a7.5n/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Human RSK2 protein, purchased from Invitrogen, is used to measure kinase activity utilizing Kinase Glo Plus (Promega) a homogeneous assay technology,...


US Patent US9073926 (2015)


BindingDB Entry DOI: 10.7270/Q2BP01J6
More data for this
Ligand-Target Pair