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5 similar compounds to monomer 50379214

Compile data set for download or QSAR
Wt: 344.3
BDBM50379216
Wt: 418.6
BDBM50379218
Wt: 355.3
BDBM50379224
Wt: 364.8
BDBM50379227
Wt: 330.3
BDBM50379228

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 22 hits for monomerid = 50379216,50379218,50379224,50379227,50379228   
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
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM50379228
PNG
(CHEMBL2011292 | US9416123, 5)
Show SMILES Nc1c(c(nn1-c1ccccc1)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H15FN4/c21-16-8-6-14(7-9-16)18-19(15-10-12-23-13-11-15)24-25(20(18)22)17-4-2-1-3-5-17/h1-13H,22H2
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n/an/a 2.40E+3n/an/an/an/a7.530



Synovo GmbH

US Patent


Assay Description
FlashPlates from Perkin Elmer (Boston, Mass., USA) with a 50 μl reaction volume are used. The reaction cocktail was pipetted in 4 steps in the fol...


US Patent US9416123 (2016)


BindingDB Entry DOI: 10.7270/Q2V123PP
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM50379228
PNG
(CHEMBL2011292 | US9416123, 5)
Show SMILES Nc1c(c(nn1-c1ccccc1)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H15FN4/c21-16-8-6-14(7-9-16)18-19(15-10-12-23-13-11-15)24-25(20(18)22)17-4-2-1-3-5-17/h1-13H,22H2
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n/an/a 2.40E+3n/an/an/an/an/an/a



Islamic University of Gaza

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2 using poly(Glu,Tyr) as substrate assessed as [33P-gamma]-ATP incorporation after 60 mins by microplate scintillation counting


J Med Chem 55: 961-5 (2012)


Article DOI: 10.1021/jm201391u
BindingDB Entry DOI: 10.7270/Q2FT8N18
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM50379216
PNG
(CHEMBL2011296 | US9416123, 10)
Show SMILES Cc1ccc(cc1)-n1nc(c(c1N)-c1ccc(F)cc1)-c1ccncc1
Show InChI InChI=1S/C21H17FN4/c1-14-2-8-18(9-3-14)26-21(23)19(15-4-6-17(22)7-5-15)20(25-26)16-10-12-24-13-11-16/h2-13H,23H2,1H3
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n/an/a 2.60E+3n/an/an/an/a7.530



Synovo GmbH

US Patent


Assay Description
FlashPlates from Perkin Elmer (Boston, Mass., USA) with a 50 μl reaction volume are used. The reaction cocktail was pipetted in 4 steps in the fol...


US Patent US9416123 (2016)


BindingDB Entry DOI: 10.7270/Q2V123PP
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM50379224
PNG
(CHEMBL2011297 | US9416123, 11)
Show SMILES Nc1c(c(nn1-c1ccc(cc1)C#N)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C21H14FN5/c22-17-5-3-15(4-6-17)19-20(16-9-11-25-12-10-16)26-27(21(19)24)18-7-1-14(13-23)2-8-18/h1-12H,24H2
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n/an/a 1.30E+3n/an/an/an/a7.530



Synovo GmbH

US Patent


Assay Description
FlashPlates from Perkin Elmer (Boston, Mass., USA) with a 50 μl reaction volume are used. The reaction cocktail was pipetted in 4 steps in the fol...


US Patent US9416123 (2016)


BindingDB Entry DOI: 10.7270/Q2V123PP
More data for this
Ligand-Target Pair
B-RAF V600E


(Homo sapiens (Human))
BDBM50379228
PNG
(CHEMBL2011292 | US9416123, 5)
Show SMILES Nc1c(c(nn1-c1ccccc1)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H15FN4/c21-16-8-6-14(7-9-16)18-19(15-10-12-23-13-11-15)24-25(20(18)22)17-4-2-1-3-5-17/h1-13H,22H2
PDB

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US Patent
n/an/a 900n/an/an/an/a7.530



Synovo GmbH

US Patent


Assay Description
FlashPlates from Perkin Elmer (Boston, Mass., USA) with a 50 μl reaction volume are used. The reaction cocktail was pipetted in 4 steps in the fol...


US Patent US9416123 (2016)


BindingDB Entry DOI: 10.7270/Q2V123PP
More data for this
Ligand-Target Pair
B-RAF V600E


(Homo sapiens (Human))
BDBM50379227
PNG
(CHEMBL2011293 | US9416123, 7)
Show SMILES Nc1c(c(nn1-c1ccc(Cl)cc1)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H14ClFN4/c21-15-3-7-17(8-4-15)26-20(23)18(13-1-5-16(22)6-2-13)19(25-26)14-9-11-24-12-10-14/h1-12H,23H2
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n/an/a 800n/an/an/an/a7.530



Synovo GmbH

US Patent


Assay Description
FlashPlates from Perkin Elmer (Boston, Mass., USA) with a 50 μl reaction volume are used. The reaction cocktail was pipetted in 4 steps in the fol...


US Patent US9416123 (2016)


BindingDB Entry DOI: 10.7270/Q2V123PP
More data for this
Ligand-Target Pair
B-RAF V600E


(Homo sapiens (Human))
BDBM50379216
PNG
(CHEMBL2011296 | US9416123, 10)
Show SMILES Cc1ccc(cc1)-n1nc(c(c1N)-c1ccc(F)cc1)-c1ccncc1
Show InChI InChI=1S/C21H17FN4/c1-14-2-8-18(9-3-14)26-21(23)19(15-4-6-17(22)7-5-15)20(25-26)16-10-12-24-13-11-16/h2-13H,23H2,1H3
PDB

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n/an/a 890n/an/an/an/a7.530



Synovo GmbH

US Patent


Assay Description
FlashPlates from Perkin Elmer (Boston, Mass., USA) with a 50 μl reaction volume are used. The reaction cocktail was pipetted in 4 steps in the fol...


US Patent US9416123 (2016)


BindingDB Entry DOI: 10.7270/Q2V123PP
More data for this
Ligand-Target Pair
B-RAF V600E


(Homo sapiens (Human))
BDBM50379224
PNG
(CHEMBL2011297 | US9416123, 11)
Show SMILES Nc1c(c(nn1-c1ccc(cc1)C#N)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C21H14FN5/c22-17-5-3-15(4-6-17)19-20(16-9-11-25-12-10-16)26-27(21(19)24)18-7-1-14(13-23)2-8-18/h1-12H,24H2
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US Patent
n/an/a 1.70E+3n/an/an/an/a7.530



Synovo GmbH

US Patent


Assay Description
FlashPlates from Perkin Elmer (Boston, Mass., USA) with a 50 μl reaction volume are used. The reaction cocktail was pipetted in 4 steps in the fol...


US Patent US9416123 (2016)


BindingDB Entry DOI: 10.7270/Q2V123PP
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50379228
PNG
(CHEMBL2011292 | US9416123, 5)
Show SMILES Nc1c(c(nn1-c1ccccc1)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H15FN4/c21-16-8-6-14(7-9-16)18-19(15-10-12-23-13-11-15)24-25(20(18)22)17-4-2-1-3-5-17/h1-13H,22H2
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n/an/a 5.20E+4n/an/an/an/a7.530



Synovo GmbH

US Patent


Assay Description
FlashPlates from Perkin Elmer (Boston, Mass., USA) with a 50 μl reaction volume are used. The reaction cocktail was pipetted in 4 steps in the fol...


US Patent US9416123 (2016)


BindingDB Entry DOI: 10.7270/Q2V123PP
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50379227
PNG
(CHEMBL2011293 | US9416123, 7)
Show SMILES Nc1c(c(nn1-c1ccc(Cl)cc1)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H14ClFN4/c21-15-3-7-17(8-4-15)26-20(23)18(13-1-5-16(22)6-2-13)19(25-26)14-9-11-24-12-10-14/h1-12H,23H2
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n/an/a 2.30E+4n/an/an/an/a7.530



Synovo GmbH

US Patent


Assay Description
FlashPlates from Perkin Elmer (Boston, Mass., USA) with a 50 μl reaction volume are used. The reaction cocktail was pipetted in 4 steps in the fol...


US Patent US9416123 (2016)


BindingDB Entry DOI: 10.7270/Q2V123PP
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50379216
PNG
(CHEMBL2011296 | US9416123, 10)
Show SMILES Cc1ccc(cc1)-n1nc(c(c1N)-c1ccc(F)cc1)-c1ccncc1
Show InChI InChI=1S/C21H17FN4/c1-14-2-8-18(9-3-14)26-21(23)19(15-4-6-17(22)7-5-15)20(25-26)16-10-12-24-13-11-16/h2-13H,23H2,1H3
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n/an/a 5.30E+4n/an/an/an/a7.530



Synovo GmbH

US Patent


Assay Description
FlashPlates from Perkin Elmer (Boston, Mass., USA) with a 50 μl reaction volume are used. The reaction cocktail was pipetted in 4 steps in the fol...


US Patent US9416123 (2016)


BindingDB Entry DOI: 10.7270/Q2V123PP
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50379224
PNG
(CHEMBL2011297 | US9416123, 11)
Show SMILES Nc1c(c(nn1-c1ccc(cc1)C#N)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C21H14FN5/c22-17-5-3-15(4-6-17)19-20(16-9-11-25-12-10-16)26-27(21(19)24)18-7-1-14(13-23)2-8-18/h1-12H,24H2
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n/an/a>1.00E+5n/an/an/an/a7.530



Synovo GmbH

US Patent


Assay Description
FlashPlates from Perkin Elmer (Boston, Mass., USA) with a 50 μl reaction volume are used. The reaction cocktail was pipetted in 4 steps in the fol...


US Patent US9416123 (2016)


BindingDB Entry DOI: 10.7270/Q2V123PP
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM50379216
PNG
(CHEMBL2011296 | US9416123, 10)
Show SMILES Cc1ccc(cc1)-n1nc(c(c1N)-c1ccc(F)cc1)-c1ccncc1
Show InChI InChI=1S/C21H17FN4/c1-14-2-8-18(9-3-14)26-21(23)19(15-4-6-17(22)7-5-15)20(25-26)16-10-12-24-13-11-16/h2-13H,23H2,1H3
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n/an/a 2.60E+3n/an/an/an/an/an/a



Islamic University of Gaza

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2 using poly(Glu,Tyr) as substrate assessed as [33P-gamma]-ATP incorporation after 60 mins by microplate scintillation counting


J Med Chem 55: 961-5 (2012)


Article DOI: 10.1021/jm201391u
BindingDB Entry DOI: 10.7270/Q2FT8N18
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50379218
PNG
(CHEMBL2011304)
Show SMILES Fc1ccc(cc1)-c1cn(nc1-c1ccncc1)-c1c(Cl)cc(Cl)cc1Cl
Show InChI InChI=1S/C20H11Cl3FN3/c21-14-9-17(22)20(18(23)10-14)27-11-16(12-1-3-15(24)4-2-12)19(26-27)13-5-7-25-8-6-13/h1-11H
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n/an/a 2.00E+3n/an/an/an/an/an/a



Islamic University of Gaza

Curated by ChEMBL


Assay Description
Inhibition of SRC using poly(Glu,Tyr) as substrate assessed as [33P-gamma]-ATP incorporation after 60 mins by microplate scintillation counting


J Med Chem 55: 961-5 (2012)


Article DOI: 10.1021/jm201391u
BindingDB Entry DOI: 10.7270/Q2FT8N18
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50379224
PNG
(CHEMBL2011297 | US9416123, 11)
Show SMILES Nc1c(c(nn1-c1ccc(cc1)C#N)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C21H14FN5/c22-17-5-3-15(4-6-17)19-20(16-9-11-25-12-10-16)26-27(21(19)24)18-7-1-14(13-23)2-8-18/h1-12H,24H2
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n/an/a>1.00E+5n/an/an/an/an/an/a



Islamic University of Gaza

Curated by ChEMBL


Assay Description
Inhibition of SRC using poly(Glu,Tyr) as substrate assessed as [33P-gamma]-ATP incorporation after 60 mins by microplate scintillation counting


J Med Chem 55: 961-5 (2012)


Article DOI: 10.1021/jm201391u
BindingDB Entry DOI: 10.7270/Q2FT8N18
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50379216
PNG
(CHEMBL2011296 | US9416123, 10)
Show SMILES Cc1ccc(cc1)-n1nc(c(c1N)-c1ccc(F)cc1)-c1ccncc1
Show InChI InChI=1S/C21H17FN4/c1-14-2-8-18(9-3-14)26-21(23)19(15-4-6-17(22)7-5-15)20(25-26)16-10-12-24-13-11-16/h2-13H,23H2,1H3
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n/an/a 5.30E+4n/an/an/an/an/an/a



Islamic University of Gaza

Curated by ChEMBL


Assay Description
Inhibition of SRC using poly(Glu,Tyr) as substrate assessed as [33P-gamma]-ATP incorporation after 60 mins by microplate scintillation counting


J Med Chem 55: 961-5 (2012)


Article DOI: 10.1021/jm201391u
BindingDB Entry DOI: 10.7270/Q2FT8N18
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50379227
PNG
(CHEMBL2011293 | US9416123, 7)
Show SMILES Nc1c(c(nn1-c1ccc(Cl)cc1)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H14ClFN4/c21-15-3-7-17(8-4-15)26-20(23)18(13-1-5-16(22)6-2-13)19(25-26)14-9-11-24-12-10-14/h1-12H,23H2
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n/an/a 2.30E+4n/an/an/an/an/an/a



Islamic University of Gaza

Curated by ChEMBL


Assay Description
Inhibition of SRC using poly(Glu,Tyr) as substrate assessed as [33P-gamma]-ATP incorporation after 60 mins by microplate scintillation counting


J Med Chem 55: 961-5 (2012)


Article DOI: 10.1021/jm201391u
BindingDB Entry DOI: 10.7270/Q2FT8N18
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50379228
PNG
(CHEMBL2011292 | US9416123, 5)
Show SMILES Nc1c(c(nn1-c1ccccc1)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H15FN4/c21-16-8-6-14(7-9-16)18-19(15-10-12-23-13-11-15)24-25(20(18)22)17-4-2-1-3-5-17/h1-13H,22H2
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n/an/a 5.20E+4n/an/an/an/an/an/a



Islamic University of Gaza

Curated by ChEMBL


Assay Description
Inhibition of SRC using poly(Glu,Tyr) as substrate assessed as [33P-gamma]-ATP incorporation after 60 mins by microplate scintillation counting


J Med Chem 55: 961-5 (2012)


Article DOI: 10.1021/jm201391u
BindingDB Entry DOI: 10.7270/Q2FT8N18
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM50379218
PNG
(CHEMBL2011304)
Show SMILES Fc1ccc(cc1)-c1cn(nc1-c1ccncc1)-c1c(Cl)cc(Cl)cc1Cl
Show InChI InChI=1S/C20H11Cl3FN3/c21-14-9-17(22)20(18(23)10-14)27-11-16(12-1-3-15(24)4-2-12)19(26-27)13-5-7-25-8-6-13/h1-11H
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n/an/a 210n/an/an/an/an/an/a



Islamic University of Gaza

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2 using poly(Glu,Tyr) as substrate assessed as [33P-gamma]-ATP incorporation after 60 mins by microplate scintillation counting


J Med Chem 55: 961-5 (2012)


Article DOI: 10.1021/jm201391u
BindingDB Entry DOI: 10.7270/Q2FT8N18
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM50379224
PNG
(CHEMBL2011297 | US9416123, 11)
Show SMILES Nc1c(c(nn1-c1ccc(cc1)C#N)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C21H14FN5/c22-17-5-3-15(4-6-17)19-20(16-9-11-25-12-10-16)26-27(21(19)24)18-7-1-14(13-23)2-8-18/h1-12H,24H2
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n/an/a 1.30E+3n/an/an/an/an/an/a



Islamic University of Gaza

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2 using poly(Glu,Tyr) as substrate assessed as [33P-gamma]-ATP incorporation after 60 mins by microplate scintillation counting


J Med Chem 55: 961-5 (2012)


Article DOI: 10.1021/jm201391u
BindingDB Entry DOI: 10.7270/Q2FT8N18
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM50379227
PNG
(CHEMBL2011293 | US9416123, 7)
Show SMILES Nc1c(c(nn1-c1ccc(Cl)cc1)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H14ClFN4/c21-15-3-7-17(8-4-15)26-20(23)18(13-1-5-16(22)6-2-13)19(25-26)14-9-11-24-12-10-14/h1-12H,23H2
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n/an/a 1.20E+3n/an/an/an/an/an/a



Islamic University of Gaza

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2 using poly(Glu,Tyr) as substrate assessed as [33P-gamma]-ATP incorporation after 60 mins by microplate scintillation counting


J Med Chem 55: 961-5 (2012)


Article DOI: 10.1021/jm201391u
BindingDB Entry DOI: 10.7270/Q2FT8N18
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM50379227
PNG
(CHEMBL2011293 | US9416123, 7)
Show SMILES Nc1c(c(nn1-c1ccc(Cl)cc1)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H14ClFN4/c21-15-3-7-17(8-4-15)26-20(23)18(13-1-5-16(22)6-2-13)19(25-26)14-9-11-24-12-10-14/h1-12H,23H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 1.20E+3n/an/an/an/a7.530



Synovo GmbH

US Patent


Assay Description
FlashPlates from Perkin Elmer (Boston, Mass., USA) with a 50 μl reaction volume are used. The reaction cocktail was pipetted in 4 steps in the fol...


US Patent US9416123 (2016)


BindingDB Entry DOI: 10.7270/Q2V123PP
More data for this
Ligand-Target Pair