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BDBM247065 3-Methoxy-N-(2-morpholinoethyl)-5-((4-((4-(3-(3-(perfluoroethyl)-1-(p-tolyl)-1H-pyrazol-5-yl)ureido)naphthalen-1-yl)oxy)pyrimidin-2-yl)amino)benzamide::US9701670, 9

SMILES: COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(F)(F)C(F)(F)F)c4ccccc34)n2)cc(c1)C(=O)NCCN1CCOCC1

InChI Key: InChIKey=HUMIGOFJWQKXPY-UHFFFAOYSA-N

Data: 8 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 247065   
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
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM247065
PNG
(3-Methoxy-N-(2-morpholinoethyl)-5-((4-((4-(3-(3-(p...)
Show SMILES COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(F)(F)C(F)(F)F)c4ccccc34)n2)cc(c1)C(=O)NCCN1CCOCC1
Show InChI InChI=1S/C41H38F5N9O5/c1-25-7-9-28(10-8-25)55-35(24-34(53-55)40(42,43)41(44,45)46)51-39(57)50-32-11-12-33(31-6-4-3-5-30(31)32)60-36-13-14-48-38(52-36)49-27-21-26(22-29(23-27)58-2)37(56)47-15-16-54-17-19-59-20-18-54/h3-14,21-24H,15-20H2,1-2H3,(H,47,56)(H,48,49,52)(H2,50,51,57)
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n/an/a 49n/an/an/an/an/an/a



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US Patent


Assay Description
The inhibitory activities of test compounds against the p38 MAPKα isoform (MAPK14: Invitrogen), are evaluated indirectly by determining the leve...


US Patent US9701670 (2017)


Article DOI: 10.1021/jm950727b
BindingDB Entry DOI: 10.7270/Q2JM2CP2
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM247065
PNG
(3-Methoxy-N-(2-morpholinoethyl)-5-((4-((4-(3-(3-(p...)
Show SMILES COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(F)(F)C(F)(F)F)c4ccccc34)n2)cc(c1)C(=O)NCCN1CCOCC1
Show InChI InChI=1S/C41H38F5N9O5/c1-25-7-9-28(10-8-25)55-35(24-34(53-55)40(42,43)41(44,45)46)51-39(57)50-32-11-12-33(31-6-4-3-5-30(31)32)60-36-13-14-48-38(52-36)49-27-21-26(22-29(23-27)58-2)37(56)47-15-16-54-17-19-59-20-18-54/h3-14,21-24H,15-20H2,1-2H3,(H,47,56)(H,48,49,52)(H2,50,51,57)
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n/an/a 2n/an/an/an/an/an/a



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US Patent


Assay Description
The inhibitory activities of compounds of the invention against c-Src and Syk enzymes (Invitrogen), are evaluated in a similar fashion to that descri...


US Patent US9701670 (2017)


Article DOI: 10.1021/jm950727b
BindingDB Entry DOI: 10.7270/Q2JM2CP2
More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM247065
PNG
(3-Methoxy-N-(2-morpholinoethyl)-5-((4-((4-(3-(3-(p...)
Show SMILES COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(F)(F)C(F)(F)F)c4ccccc34)n2)cc(c1)C(=O)NCCN1CCOCC1
Show InChI InChI=1S/C41H38F5N9O5/c1-25-7-9-28(10-8-25)55-35(24-34(53-55)40(42,43)41(44,45)46)51-39(57)50-32-11-12-33(31-6-4-3-5-30(31)32)60-36-13-14-48-38(52-36)49-27-21-26(22-29(23-27)58-2)37(56)47-15-16-54-17-19-59-20-18-54/h3-14,21-24H,15-20H2,1-2H3,(H,47,56)(H,48,49,52)(H2,50,51,57)
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n/an/a 41n/an/an/an/an/an/a



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US Patent


Assay Description
The inhibitory activities of compounds of the invention against Syk enzymes (Invitrogen), are evaluated in a similar fashion to that described herein...


US Patent US9701670 (2017)


Article DOI: 10.1021/jm950727b
BindingDB Entry DOI: 10.7270/Q2JM2CP2
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3


(Homo sapiens (Human))
BDBM247065
PNG
(3-Methoxy-N-(2-morpholinoethyl)-5-((4-((4-(3-(3-(p...)
Show SMILES COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(F)(F)C(F)(F)F)c4ccccc34)n2)cc(c1)C(=O)NCCN1CCOCC1
Show InChI InChI=1S/C41H38F5N9O5/c1-25-7-9-28(10-8-25)55-35(24-34(53-55)40(42,43)41(44,45)46)51-39(57)50-32-11-12-33(31-6-4-3-5-30(31)32)60-36-13-14-48-38(52-36)49-27-21-26(22-29(23-27)58-2)37(56)47-15-16-54-17-19-59-20-18-54/h3-14,21-24H,15-20H2,1-2H3,(H,47,56)(H,48,49,52)(H2,50,51,57)
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n/an/a 6.51E+3n/an/an/an/an/an/a



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Assay Description
The inhibitory activities of compounds of the invention against the GSK 3α enzyme isoform (Invitrogen), are evaluated by determining the level o...


US Patent US9701670 (2017)


Article DOI: 10.1021/jm950727b
BindingDB Entry DOI: 10.7270/Q2JM2CP2
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM247065
PNG
(3-Methoxy-N-(2-morpholinoethyl)-5-((4-((4-(3-(3-(p...)
Show SMILES COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(F)(F)C(F)(F)F)c4ccccc34)n2)cc(c1)C(=O)NCCN1CCOCC1
Show InChI InChI=1S/C41H38F5N9O5/c1-25-7-9-28(10-8-25)55-35(24-34(53-55)40(42,43)41(44,45)46)51-39(57)50-32-11-12-33(31-6-4-3-5-30(31)32)60-36-13-14-48-38(52-36)49-27-21-26(22-29(23-27)58-2)37(56)47-15-16-54-17-19-59-20-18-54/h3-14,21-24H,15-20H2,1-2H3,(H,47,56)(H,48,49,52)(H2,50,51,57)
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n/an/a 174n/an/an/an/an/an/a



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US Patent


Assay Description
The inhibitory activities of test compounds against the p38 MAPKα isoform (MAPK14: Invitrogen), are evaluated indirectly by determining the leve...


US Patent US9701670 (2017)


Article DOI: 10.1021/jm950727b
BindingDB Entry DOI: 10.7270/Q2JM2CP2
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM247065
PNG
(3-Methoxy-N-(2-morpholinoethyl)-5-((4-((4-(3-(3-(p...)
Show SMILES COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(F)(F)C(F)(F)F)c4ccccc34)n2)cc(c1)C(=O)NCCN1CCOCC1
Show InChI InChI=1S/C41H38F5N9O5/c1-25-7-9-28(10-8-25)55-35(24-34(53-55)40(42,43)41(44,45)46)51-39(57)50-32-11-12-33(31-6-4-3-5-30(31)32)60-36-13-14-48-38(52-36)49-27-21-26(22-29(23-27)58-2)37(56)47-15-16-54-17-19-59-20-18-54/h3-14,21-24H,15-20H2,1-2H3,(H,47,56)(H,48,49,52)(H2,50,51,57)
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n/an/a 21n/an/an/an/an/an/a



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US Patent


Assay Description
The inhibitory activities of compounds of the invention against c-Src and Syk enzymes (Invitrogen), are evaluated in a similar fashion to that descri...


US Patent US9701670 (2017)


Article DOI: 10.1021/jm950727b
BindingDB Entry DOI: 10.7270/Q2JM2CP2
More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM247065
PNG
(3-Methoxy-N-(2-morpholinoethyl)-5-((4-((4-(3-(3-(p...)
Show SMILES COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(F)(F)C(F)(F)F)c4ccccc34)n2)cc(c1)C(=O)NCCN1CCOCC1
Show InChI InChI=1S/C41H38F5N9O5/c1-25-7-9-28(10-8-25)55-35(24-34(53-55)40(42,43)41(44,45)46)51-39(57)50-32-11-12-33(31-6-4-3-5-30(31)32)60-36-13-14-48-38(52-36)49-27-21-26(22-29(23-27)58-2)37(56)47-15-16-54-17-19-59-20-18-54/h3-14,21-24H,15-20H2,1-2H3,(H,47,56)(H,48,49,52)(H2,50,51,57)
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n/an/a 43n/an/an/an/an/an/a



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US Patent


Assay Description
The inhibitory activities of compounds of the invention against Syk enzymes (Invitrogen), are evaluated in a similar fashion to that described herein...


US Patent US9701670 (2017)


Article DOI: 10.1021/jm950727b
BindingDB Entry DOI: 10.7270/Q2JM2CP2
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3


(Homo sapiens (Human))
BDBM247065
PNG
(3-Methoxy-N-(2-morpholinoethyl)-5-((4-((4-(3-(3-(p...)
Show SMILES COc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(nn4-c4ccc(C)cc4)C(F)(F)C(F)(F)F)c4ccccc34)n2)cc(c1)C(=O)NCCN1CCOCC1
Show InChI InChI=1S/C41H38F5N9O5/c1-25-7-9-28(10-8-25)55-35(24-34(53-55)40(42,43)41(44,45)46)51-39(57)50-32-11-12-33(31-6-4-3-5-30(31)32)60-36-13-14-48-38(52-36)49-27-21-26(22-29(23-27)58-2)37(56)47-15-16-54-17-19-59-20-18-54/h3-14,21-24H,15-20H2,1-2H3,(H,47,56)(H,48,49,52)(H2,50,51,57)
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n/an/a 8.03E+3n/an/an/an/an/an/a



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US Patent


Assay Description
The inhibitory activities of compounds of the invention against the GSK 3α enzyme isoform (Invitrogen), are evaluated by determining the level o...


US Patent US9701670 (2017)


Article DOI: 10.1021/jm950727b
BindingDB Entry DOI: 10.7270/Q2JM2CP2
More data for this
Ligand-Target Pair