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Patent code US9416123

Compile Data Set for Download or QSAR
Found 85 hits of Enzyme Inhibition Constant Data   
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
Epidermal growth factor receptor


(Homo sapiens (human))
BDBM5447
PNG
(CHEMBL939 | GEFITINIB | Iressa | N-(3-Chloro-4-flu...)
Show SMILES COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C22H24ClFN4O3/c1-29-20-13-19-16(12-21(20)31-8-2-5-28-6-9-30-10-7-28)22(26-14-25-19)27-15-3-4-18(24)17(23)11-15/h3-4,11-14H,2,5-10H2,1H3,(H,25,26,27)
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US Patent
n/an/a 1.40n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Epidermal growth factor receptor(L858R)


(Homo sapiens)
BDBM5447
PNG
(CHEMBL939 | GEFITINIB | Iressa | N-(3-Chloro-4-flu...)
Show SMILES COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C22H24ClFN4O3/c1-29-20-13-19-16(12-21(20)31-8-2-5-28-6-9-30-10-7-28)22(26-14-25-19)27-15-3-4-18(24)17(23)11-15/h3-4,11-14H,2,5-10H2,1H3,(H,25,26,27)
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US Patent
n/an/a 1.60n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Epidermal growth factor receptor (EGFR)(d752-759)


(Homo sapiens (Human))
BDBM5447
PNG
(CHEMBL939 | GEFITINIB | Iressa | N-(3-Chloro-4-flu...)
Show SMILES COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C22H24ClFN4O3/c1-29-20-13-19-16(12-21(20)31-8-2-5-28-6-9-30-10-7-28)22(26-14-25-19)27-15-3-4-18(24)17(23)11-15/h3-4,11-14H,2,5-10H2,1H3,(H,25,26,27)
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US Patent
n/an/a 2.10n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Epidermal growth factor receptor (EGFR)(d747-752)(P753S)


(Homo sapiens (Human))
BDBM5447
PNG
(CHEMBL939 | GEFITINIB | Iressa | N-(3-Chloro-4-flu...)
Show SMILES COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C22H24ClFN4O3/c1-29-20-13-19-16(12-21(20)31-8-2-5-28-6-9-30-10-7-28)22(26-14-25-19)27-15-3-4-18(24)17(23)11-15/h3-4,11-14H,2,5-10H2,1H3,(H,25,26,27)
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n/an/a 2.20n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Epidermal growth factor receptor (EGFR)(L861Q)


(Homo sapiens (Human))
BDBM5447
PNG
(CHEMBL939 | GEFITINIB | Iressa | N-(3-Chloro-4-flu...)
Show SMILES COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C22H24ClFN4O3/c1-29-20-13-19-16(12-21(20)31-8-2-5-28-6-9-30-10-7-28)22(26-14-25-19)27-15-3-4-18(24)17(23)11-15/h3-4,11-14H,2,5-10H2,1H3,(H,25,26,27)
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n/an/a 2.20n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (human))
BDBM5447
PNG
(CHEMBL939 | GEFITINIB | Iressa | N-(3-Chloro-4-flu...)
Show SMILES COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C22H24ClFN4O3/c1-29-20-13-19-16(12-21(20)31-8-2-5-28-6-9-30-10-7-28)22(26-14-25-19)27-15-3-4-18(24)17(23)11-15/h3-4,11-14H,2,5-10H2,1H3,(H,25,26,27)
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US Patent
n/an/a 3n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Epidermal growth factor receptor (EGFR)(d747-749)(A750P)


(Homo sapiens (Human))
BDBM5447
PNG
(CHEMBL939 | GEFITINIB | Iressa | N-(3-Chloro-4-flu...)
Show SMILES COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C22H24ClFN4O3/c1-29-20-13-19-16(12-21(20)31-8-2-5-28-6-9-30-10-7-28)22(26-14-25-19)27-15-3-4-18(24)17(23)11-15/h3-4,11-14H,2,5-10H2,1H3,(H,25,26,27)
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n/an/a 3.10n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase RIPK2


(Homo sapiens (Human))
BDBM5447
PNG
(CHEMBL939 | GEFITINIB | Iressa | N-(3-Chloro-4-flu...)
Show SMILES COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C22H24ClFN4O3/c1-29-20-13-19-16(12-21(20)31-8-2-5-28-6-9-30-10-7-28)22(26-14-25-19)27-15-3-4-18(24)17(23)11-15/h3-4,11-14H,2,5-10H2,1H3,(H,25,26,27)
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n/an/a 3.80n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Epidermal growth factor receptor (EGFR)(G719C)


(Homo sapiens (Human))
BDBM5447
PNG
(CHEMBL939 | GEFITINIB | Iressa | N-(3-Chloro-4-flu...)
Show SMILES COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C22H24ClFN4O3/c1-29-20-13-19-16(12-21(20)31-8-2-5-28-6-9-30-10-7-28)22(26-14-25-19)27-15-3-4-18(24)17(23)11-15/h3-4,11-14H,2,5-10H2,1H3,(H,25,26,27)
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n/an/a 4n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Epidermal growth factor receptor (EGFR)(G719S)


(Homo sapiens (Human))
BDBM5447
PNG
(CHEMBL939 | GEFITINIB | Iressa | N-(3-Chloro-4-flu...)
Show SMILES COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C22H24ClFN4O3/c1-29-20-13-19-16(12-21(20)31-8-2-5-28-6-9-30-10-7-28)22(26-14-25-19)27-15-3-4-18(24)17(23)11-15/h3-4,11-14H,2,5-10H2,1H3,(H,25,26,27)
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US Patent
n/an/a 6.70n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50379214
PNG
(CHEMBL2011291 | US9416123, 6)
Show SMILES Nc1c(c(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H12Cl3FN4/c21-13-9-15(22)19(16(23)10-13)28-20(25)17(11-1-3-14(24)4-2-11)18(27-28)12-5-7-26-8-6-12/h1-10H,25H2
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n/an/a 29n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine kinase non-receptor protein 2


(Homo sapiens (Human))
BDBM50379214
PNG
(CHEMBL2011291 | US9416123, 6)
Show SMILES Nc1c(c(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H12Cl3FN4/c21-13-9-15(22)19(16(23)10-13)28-20(25)17(11-1-3-14(24)4-2-11)18(27-28)12-5-7-26-8-6-12/h1-10H,25H2
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n/an/a 33n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50379214
PNG
(CHEMBL2011291 | US9416123, 6)
Show SMILES Nc1c(c(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H12Cl3FN4/c21-13-9-15(22)19(16(23)10-13)28-20(25)17(11-1-3-14(24)4-2-11)18(27-28)12-5-7-26-8-6-12/h1-10H,25H2
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n/an/a 34n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase RIPK2


(Homo sapiens (Human))
BDBM50379214
PNG
(CHEMBL2011291 | US9416123, 6)
Show SMILES Nc1c(c(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H12Cl3FN4/c21-13-9-15(22)19(16(23)10-13)28-20(25)17(11-1-3-14(24)4-2-11)18(27-28)12-5-7-26-8-6-12/h1-10H,25H2
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n/an/a 41n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (human))
BDBM50379214
PNG
(CHEMBL2011291 | US9416123, 6)
Show SMILES Nc1c(c(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H12Cl3FN4/c21-13-9-15(22)19(16(23)10-13)28-20(25)17(11-1-3-14(24)4-2-11)18(27-28)12-5-7-26-8-6-12/h1-10H,25H2
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n/an/a 50n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase BRK


(Homo sapiens (human))
BDBM50379214
PNG
(CHEMBL2011291 | US9416123, 6)
Show SMILES Nc1c(c(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H12Cl3FN4/c21-13-9-15(22)19(16(23)10-13)28-20(25)17(11-1-3-14(24)4-2-11)18(27-28)12-5-7-26-8-6-12/h1-10H,25H2
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n/an/a 61n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Epidermal growth factor receptor(L858R)


(Homo sapiens)
BDBM50379214
PNG
(CHEMBL2011291 | US9416123, 6)
Show SMILES Nc1c(c(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H12Cl3FN4/c21-13-9-15(22)19(16(23)10-13)28-20(25)17(11-1-3-14(24)4-2-11)18(27-28)12-5-7-26-8-6-12/h1-10H,25H2
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US Patent
n/an/a 67n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Epidermal growth factor receptor (EGFR)(d752-759)


(Homo sapiens (Human))
BDBM50379214
PNG
(CHEMBL2011291 | US9416123, 6)
Show SMILES Nc1c(c(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H12Cl3FN4/c21-13-9-15(22)19(16(23)10-13)28-20(25)17(11-1-3-14(24)4-2-11)18(27-28)12-5-7-26-8-6-12/h1-10H,25H2
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n/an/a 91n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Misshapen-like kinase 1 (MINK1)


(Homo sapiens (Human))
BDBM50379214
PNG
(CHEMBL2011291 | US9416123, 6)
Show SMILES Nc1c(c(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H12Cl3FN4/c21-13-9-15(22)19(16(23)10-13)28-20(25)17(11-1-3-14(24)4-2-11)18(27-28)12-5-7-26-8-6-12/h1-10H,25H2
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n/an/a 99n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (human))
BDBM50379214
PNG
(CHEMBL2011291 | US9416123, 6)
Show SMILES Nc1c(c(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H12Cl3FN4/c21-13-9-15(22)19(16(23)10-13)28-20(25)17(11-1-3-14(24)4-2-11)18(27-28)12-5-7-26-8-6-12/h1-10H,25H2
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US Patent
n/an/a 110n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Epidermal growth factor receptor(L858R)


(Homo sapiens)
BDBM50379214
PNG
(CHEMBL2011291 | US9416123, 6)
Show SMILES Nc1c(c(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H12Cl3FN4/c21-13-9-15(22)19(16(23)10-13)28-20(25)17(11-1-3-14(24)4-2-11)18(27-28)12-5-7-26-8-6-12/h1-10H,25H2
PDB

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US Patent
n/an/a 110n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Epidermal growth factor receptor (EGFR)(d747-752)(P753S)


(Homo sapiens (Human))
BDBM50379214
PNG
(CHEMBL2011291 | US9416123, 6)
Show SMILES Nc1c(c(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H12Cl3FN4/c21-13-9-15(22)19(16(23)10-13)28-20(25)17(11-1-3-14(24)4-2-11)18(27-28)12-5-7-26-8-6-12/h1-10H,25H2
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n/an/a 110n/an/an/an/an/an/a



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...


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More data for this
Ligand-Target Pair
Epidermal growth factor receptor (EGFR)(L861Q)


(Homo sapiens (Human))
BDBM50379214
PNG
(CHEMBL2011291 | US9416123, 6)
Show SMILES Nc1c(c(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H12Cl3FN4/c21-13-9-15(22)19(16(23)10-13)28-20(25)17(11-1-3-14(24)4-2-11)18(27-28)12-5-7-26-8-6-12/h1-10H,25H2
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n/an/a 150n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Epidermal growth factor receptor (EGFR)(d747-749)(A750P)


(Homo sapiens (Human))
BDBM50379214
PNG
(CHEMBL2011291 | US9416123, 6)
Show SMILES Nc1c(c(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H12Cl3FN4/c21-13-9-15(22)19(16(23)10-13)28-20(25)17(11-1-3-14(24)4-2-11)18(27-28)12-5-7-26-8-6-12/h1-10H,25H2
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n/an/a 170n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (human))
BDBM50379214
PNG
(CHEMBL2011291 | US9416123, 6)
Show SMILES Nc1c(c(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H12Cl3FN4/c21-13-9-15(22)19(16(23)10-13)28-20(25)17(11-1-3-14(24)4-2-11)18(27-28)12-5-7-26-8-6-12/h1-10H,25H2
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n/an/a 210n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM241822
PNG
(US9416123, 3a)
Show SMILES Clc1cc(Cl)c(N\N=C\c2ccncc2)c(Cl)c1
Show InChI InChI=1S/C12H8Cl3N3/c13-9-5-10(14)12(11(15)6-9)18-17-7-8-1-3-16-4-2-8/h1-7,18H/b17-7+
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n/an/a 210n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
RAF serine/threonine protein kinase


(Homo sapiens (human))
BDBM50379214
PNG
(CHEMBL2011291 | US9416123, 6)
Show SMILES Nc1c(c(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H12Cl3FN4/c21-13-9-15(22)19(16(23)10-13)28-20(25)17(11-1-3-14(24)4-2-11)18(27-28)12-5-7-26-8-6-12/h1-10H,25H2
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n/an/a 270n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
VEGF-receptor 2 and tyrosine-protein kinase SRC


(Homo sapiens (Human))
BDBM50379214
PNG
(CHEMBL2011291 | US9416123, 6)
Show SMILES Nc1c(c(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H12Cl3FN4/c21-13-9-15(22)19(16(23)10-13)28-20(25)17(11-1-3-14(24)4-2-11)18(27-28)12-5-7-26-8-6-12/h1-10H,25H2
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n/an/a 270n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Epidermal growth factor receptor (T790M)


(Homo sapiens (Human))
BDBM5447
PNG
(CHEMBL939 | GEFITINIB | Iressa | N-(3-Chloro-4-flu...)
Show SMILES COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C22H24ClFN4O3/c1-29-20-13-19-16(12-21(20)31-8-2-5-28-6-9-30-10-7-28)22(26-14-25-19)27-15-3-4-18(24)17(23)11-15/h3-4,11-14H,2,5-10H2,1H3,(H,25,26,27)
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n/an/a 280n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
VEGF-receptor 2 and tyrosine-protein kinase SRC


(Homo sapiens (Human))
BDBM50379214
PNG
(CHEMBL2011291 | US9416123, 6)
Show SMILES Nc1c(c(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H12Cl3FN4/c21-13-9-15(22)19(16(23)10-13)28-20(25)17(11-1-3-14(24)4-2-11)18(27-28)12-5-7-26-8-6-12/h1-10H,25H2
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n/an/a 400n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
B-RAF V600E


(Homo sapiens (Human))
BDBM50379214
PNG
(CHEMBL2011291 | US9416123, 6)
Show SMILES Nc1c(c(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H12Cl3FN4/c21-13-9-15(22)19(16(23)10-13)28-20(25)17(11-1-3-14(24)4-2-11)18(27-28)12-5-7-26-8-6-12/h1-10H,25H2
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n/an/a 420n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
B-RAF V600E


(Homo sapiens (Human))
BDBM50379214
PNG
(CHEMBL2011291 | US9416123, 6)
Show SMILES Nc1c(c(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H12Cl3FN4/c21-13-9-15(22)19(16(23)10-13)28-20(25)17(11-1-3-14(24)4-2-11)18(27-28)12-5-7-26-8-6-12/h1-10H,25H2
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n/an/a 590n/an/an/an/an/an/a



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...


Citation and Details
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/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
B-RAF V600E


(Homo sapiens (Human))
BDBM50379226
PNG
(CHEMBL2011294 | US9416123, 8)
Show SMILES COc1ccc(cc1)-n1nc(c(c1N)-c1ccc(F)cc1)-c1ccncc1
Show InChI InChI=1S/C21H17FN4O/c1-27-18-8-6-17(7-9-18)26-21(23)19(14-2-4-16(22)5-3-14)20(25-26)15-10-12-24-13-11-15/h2-13H,23H2,1H3
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n/an/a 860n/an/an/an/an/an/a



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...


Citation and Details
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
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n/an/a 890n/an/an/an/an/an/a



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...


Citation and Details
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
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n/an/a 900n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase BRK


(Homo sapiens (human))
BDBM5447
PNG
(CHEMBL939 | GEFITINIB | Iressa | N-(3-Chloro-4-flu...)
Show SMILES COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C22H24ClFN4O3/c1-29-20-13-19-16(12-21(20)31-8-2-5-28-6-9-30-10-7-28)22(26-14-25-19)27-15-3-4-18(24)17(23)11-15/h3-4,11-14H,2,5-10H2,1H3,(H,25,26,27)
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n/an/a 980n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
B-RAF V600E


(Homo sapiens (Human))
BDBM50379214
PNG
(CHEMBL2011291 | US9416123, 6)
Show SMILES Nc1c(c(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H12Cl3FN4/c21-13-9-15(22)19(16(23)10-13)28-20(25)17(11-1-3-14(24)4-2-11)18(27-28)12-5-7-26-8-6-12/h1-10H,25H2
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n/an/a 990n/an/an/an/an/an/a



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...


Citation and Details
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



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...


Citation and Details
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



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...


Citation and Details
More data for this
Ligand-Target Pair
B-RAF V600E


(Homo sapiens (Human))
BDBM50379225
PNG
(CHEMBL2011295 | US9416123, 9)
Show SMILES Nc1c(c(nn1-c1ccc(cc1)[N+]([O-])=O)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H14FN5O2/c21-15-3-1-13(2-4-15)18-19(14-9-11-23-12-10-14)24-25(20(18)22)16-5-7-17(8-6-16)26(27)28/h1-12H,22H2
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n/an/a 1.40E+3n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Epidermal growth factor receptor (EGFR)(G719C)


(Homo sapiens (Human))
BDBM50379214
PNG
(CHEMBL2011291 | US9416123, 6)
Show SMILES Nc1c(c(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H12Cl3FN4/c21-13-9-15(22)19(16(23)10-13)28-20(25)17(11-1-3-14(24)4-2-11)18(27-28)12-5-7-26-8-6-12/h1-10H,25H2
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n/an/a 1.40E+3n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50379225
PNG
(CHEMBL2011295 | US9416123, 9)
Show SMILES Nc1c(c(nn1-c1ccc(cc1)[N+]([O-])=O)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H14FN5O2/c21-15-3-1-13(2-4-15)18-19(14-9-11-23-12-10-14)24-25(20(18)22)16-5-7-17(8-6-16)26(27)28/h1-12H,22H2
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n/an/a 1.40E+3n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
B-RAF V600E


(Homo sapiens (Human))
BDBM50379223
PNG
(CHEMBL2011298 | US9416123, 12)
Show SMILES Nc1c(c(nn1-c1ccc(cc1)C(F)(F)F)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C21H14F4N4/c22-16-5-1-13(2-6-16)18-19(14-9-11-27-12-10-14)28-29(20(18)26)17-7-3-15(4-8-17)21(23,24)25/h1-12H,26H2
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n/an/a 1.50E+3n/an/an/an/an/an/a



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...


Citation and Details
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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n/an/a 1.70E+3n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Epidermal growth factor receptor(L858R, T790M)


(Homo sapiens)
BDBM50379214
PNG
(CHEMBL2011291 | US9416123, 6)
Show SMILES Nc1c(c(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H12Cl3FN4/c21-13-9-15(22)19(16(23)10-13)28-20(25)17(11-1-3-14(24)4-2-11)18(27-28)12-5-7-26-8-6-12/h1-10H,25H2
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n/an/a 1.78E+3n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50379226
PNG
(CHEMBL2011294 | US9416123, 8)
Show SMILES COc1ccc(cc1)-n1nc(c(c1N)-c1ccc(F)cc1)-c1ccncc1
Show InChI InChI=1S/C21H17FN4O/c1-27-18-8-6-17(7-9-18)26-21(23)19(14-2-4-16(22)5-3-14)20(25-26)15-10-12-24-13-11-15/h2-13H,23H2,1H3
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n/an/a 1.90E+3n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Epidermal growth factor receptor (T790M)


(Homo sapiens (Human))
BDBM50379214
PNG
(CHEMBL2011291 | US9416123, 6)
Show SMILES Nc1c(c(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H12Cl3FN4/c21-13-9-15(22)19(16(23)10-13)28-20(25)17(11-1-3-14(24)4-2-11)18(27-28)12-5-7-26-8-6-12/h1-10H,25H2
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n/an/a 2.00E+3n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
VEGF-receptor 2 and tyrosine-protein kinase SRC


(Homo sapiens (Human))
BDBM241822
PNG
(US9416123, 3a)
Show SMILES Clc1cc(Cl)c(N\N=C\c2ccncc2)c(Cl)c1
Show InChI InChI=1S/C12H8Cl3N3/c13-9-5-10(14)12(11(15)6-9)18-17-7-8-1-3-16-4-2-8/h1-7,18H/b17-7+
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n/an/a 2.00E+3n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine kinase non-receptor protein 2


(Homo sapiens (Human))
BDBM5447
PNG
(CHEMBL939 | GEFITINIB | Iressa | N-(3-Chloro-4-flu...)
Show SMILES COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C22H24ClFN4O3/c1-29-20-13-19-16(12-21(20)31-8-2-5-28-6-9-30-10-7-28)22(26-14-25-19)27-15-3-4-18(24)17(23)11-15/h3-4,11-14H,2,5-10H2,1H3,(H,25,26,27)
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n/an/a 2.30E+3n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50379223
PNG
(CHEMBL2011298 | US9416123, 12)
Show SMILES Nc1c(c(nn1-c1ccc(cc1)C(F)(F)F)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C21H14F4N4/c22-16-5-1-13(2-6-16)18-19(14-9-11-27-12-10-14)28-29(20(18)26)17-7-3-15(4-8-17)21(23,24)25/h1-12H,26H2
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n/an/a 2.40E+3n/an/an/an/an/an/a



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...


Citation and Details
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



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...


Citation and Details
More data for this
Ligand-Target Pair
B-RAF V600E


(Homo sapiens (Human))
BDBM241822
PNG
(US9416123, 3a)
Show SMILES Clc1cc(Cl)c(N\N=C\c2ccncc2)c(Cl)c1
Show InChI InChI=1S/C12H8Cl3N3/c13-9-5-10(14)12(11(15)6-9)18-17-7-8-1-3-16-4-2-8/h1-7,18H/b17-7+
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n/an/a 2.50E+3n/an/an/an/an/an/a



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...


Citation and Details
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



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...


Citation and Details
More data for this
Ligand-Target Pair
Epidermal growth factor receptor (EGFR)(G719S)


(Homo sapiens (Human))
BDBM50379214
PNG
(CHEMBL2011291 | US9416123, 6)
Show SMILES Nc1c(c(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H12Cl3FN4/c21-13-9-15(22)19(16(23)10-13)28-20(25)17(11-1-3-14(24)4-2-11)18(27-28)12-5-7-26-8-6-12/h1-10H,25H2
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n/an/a 2.60E+3n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
B-RAF V600E


(Homo sapiens (Human))
BDBM50379217
PNG
(CHEMBL2011305 | US9416123, 20)
Show SMILES Fc1ccc(cc1)-c1cn(nc1-c1ccncc1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C21H13F4N3/c22-17-5-1-14(2-6-17)19-13-28(27-20(19)15-9-11-26-12-10-15)18-7-3-16(4-8-18)21(23,24)25/h1-13H
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n/an/a 2.70E+3n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Epidermal growth factor receptor(L858R, T790M)


(Homo sapiens)
BDBM50379214
PNG
(CHEMBL2011291 | US9416123, 6)
Show SMILES Nc1c(c(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H12Cl3FN4/c21-13-9-15(22)19(16(23)10-13)28-20(25)17(11-1-3-14(24)4-2-11)18(27-28)12-5-7-26-8-6-12/h1-10H,25H2
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n/an/a 2.80E+3n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Epidermal growth factor receptor(L858R, T790M)


(Homo sapiens)
BDBM5447
PNG
(CHEMBL939 | GEFITINIB | Iressa | N-(3-Chloro-4-flu...)
Show SMILES COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C22H24ClFN4O3/c1-29-20-13-19-16(12-21(20)31-8-2-5-28-6-9-30-10-7-28)22(26-14-25-19)27-15-3-4-18(24)17(23)11-15/h3-4,11-14H,2,5-10H2,1H3,(H,25,26,27)
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n/an/a 3.10E+3n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Epidermal growth factor receptor (T790M)


(Homo sapiens (Human))
BDBM50379214
PNG
(CHEMBL2011291 | US9416123, 6)
Show SMILES Nc1c(c(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H12Cl3FN4/c21-13-9-15(22)19(16(23)10-13)28-20(25)17(11-1-3-14(24)4-2-11)18(27-28)12-5-7-26-8-6-12/h1-10H,25H2
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n/an/a 3.30E+3n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
VEGF-receptor 2 and tyrosine-protein kinase SRC


(Homo sapiens (Human))
BDBM50379222
PNG
(CHEMBL2011299 | US9416123, 14)
Show SMILES NC(=O)c1c(N)n(nc1-c1ccncc1)-c1c(Cl)cc(Cl)cc1Cl
Show InChI InChI=1S/C15H10Cl3N5O/c16-8-5-9(17)13(10(18)6-8)23-14(19)11(15(20)24)12(22-23)7-1-3-21-4-2-7/h1-6H,19H2,(H2,20,24)
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n/an/a 6.40E+3n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
VEGF-receptor 2 and tyrosine-protein kinase SRC


(Homo sapiens (Human))
BDBM50379223
PNG
(CHEMBL2011298 | US9416123, 12)
Show SMILES Nc1c(c(nn1-c1ccc(cc1)C(F)(F)F)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C21H14F4N4/c22-16-5-1-13(2-6-16)18-19(14-9-11-27-12-10-14)28-29(20(18)26)17-7-3-15(4-8-17)21(23,24)25/h1-12H,26H2
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n/an/a 6.70E+3n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
VEGF-receptor 2 and tyrosine-protein kinase SRC


(Homo sapiens (Human))
BDBM50379217
PNG
(CHEMBL2011305 | US9416123, 20)
Show SMILES Fc1ccc(cc1)-c1cn(nc1-c1ccncc1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C21H13F4N3/c22-17-5-1-14(2-6-17)19-13-28(27-20(19)15-9-11-26-12-10-15)18-7-3-16(4-8-18)21(23,24)25/h1-13H
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n/an/a 1.20E+4n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Misshapen-like kinase 1 (MINK1)


(Homo sapiens (Human))
BDBM5447
PNG
(CHEMBL939 | GEFITINIB | Iressa | N-(3-Chloro-4-flu...)
Show SMILES COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C22H24ClFN4O3/c1-29-20-13-19-16(12-21(20)31-8-2-5-28-6-9-30-10-7-28)22(26-14-25-19)27-15-3-4-18(24)17(23)11-15/h3-4,11-14H,2,5-10H2,1H3,(H,25,26,27)
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n/an/a 1.50E+4n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
VEGF-receptor 2 and tyrosine-protein kinase SRC


(Homo sapiens (Human))
BDBM50379215
PNG
(CHEMBL2011301 | US9416123, 18)
Show SMILES NC(=O)c1c(N)n(nc1-c1ccncc1)-c1ccccc1
Show InChI InChI=1S/C15H13N5O/c16-14-12(15(17)21)13(10-6-8-18-9-7-10)19-20(14)11-4-2-1-3-5-11/h1-9H,16H2,(H2,17,21)
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n/an/a 1.90E+4n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
VEGF-receptor 2 and tyrosine-protein kinase SRC


(Homo sapiens (Human))
BDBM50379226
PNG
(CHEMBL2011294 | US9416123, 8)
Show SMILES COc1ccc(cc1)-n1nc(c(c1N)-c1ccc(F)cc1)-c1ccncc1
Show InChI InChI=1S/C21H17FN4O/c1-27-18-8-6-17(7-9-18)26-21(23)19(14-2-4-16(22)5-3-14)20(25-26)15-10-12-24-13-11-15/h2-13H,23H2,1H3
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n/an/a 2.30E+4n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
VEGF-receptor 2 and 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



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...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50379217
PNG
(CHEMBL2011305 | US9416123, 20)
Show SMILES Fc1ccc(cc1)-c1cn(nc1-c1ccncc1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C21H13F4N3/c22-17-5-1-14(2-6-17)19-13-28(27-20(19)15-9-11-26-12-10-15)18-7-3-16(4-8-18)21(23,24)25/h1-13H
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n/an/a 2.70E+4n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
B-RAF V600E


(Homo sapiens (Human))
BDBM5447
PNG
(CHEMBL939 | GEFITINIB | Iressa | N-(3-Chloro-4-flu...)
Show SMILES COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C22H24ClFN4O3/c1-29-20-13-19-16(12-21(20)31-8-2-5-28-6-9-30-10-7-28)22(26-14-25-19)27-15-3-4-18(24)17(23)11-15/h3-4,11-14H,2,5-10H2,1H3,(H,25,26,27)
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n/an/a 3.00E+4n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50379222
PNG
(CHEMBL2011299 | US9416123, 14)
Show SMILES NC(=O)c1c(N)n(nc1-c1ccncc1)-c1c(Cl)cc(Cl)cc1Cl
Show InChI InChI=1S/C15H10Cl3N5O/c16-8-5-9(17)13(10(18)6-8)23-14(19)11(15(20)24)12(22-23)7-1-3-21-4-2-7/h1-6H,19H2,(H2,20,24)
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US Patent
n/an/a 3.10E+4n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50379220
PNG
(CHEMBL2011302 | US9416123, 16)
Show SMILES Nc1c(C(O)=O)c(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1
Show InChI InChI=1S/C15H9Cl3N4O2/c16-8-5-9(17)13(10(18)6-8)22-14(19)11(15(23)24)12(21-22)7-1-3-20-4-2-7/h1-6H,19H2,(H,23,24)
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US Patent
n/an/a 4.30E+4n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50379215
PNG
(CHEMBL2011301 | US9416123, 18)
Show SMILES NC(=O)c1c(N)n(nc1-c1ccncc1)-c1ccccc1
Show InChI InChI=1S/C15H13N5O/c16-14-12(15(17)21)13(10-6-8-18-9-7-10)19-20(14)11-4-2-1-3-5-11/h1-9H,16H2,(H2,17,21)
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n/an/a 4.80E+4n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
VEGF-receptor 2 and 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



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...


Citation and Details
More data for this
Ligand-Target Pair
VEGF-receptor 2 and 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



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...


Citation and Details
More data for this
Ligand-Target Pair
VEGF-receptor 2 and tyrosine-protein kinase SRC


(Homo sapiens (Human))
BDBM50379220
PNG
(CHEMBL2011302 | US9416123, 16)
Show SMILES Nc1c(C(O)=O)c(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1
Show InChI InChI=1S/C15H9Cl3N4O2/c16-8-5-9(17)13(10(18)6-8)22-14(19)11(15(23)24)12(21-22)7-1-3-20-4-2-7/h1-6H,19H2,(H,23,24)
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n/an/a 5.50E+4n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
B-RAF V600E


(Homo sapiens (Human))
BDBM50379215
PNG
(CHEMBL2011301 | US9416123, 18)
Show SMILES NC(=O)c1c(N)n(nc1-c1ccncc1)-c1ccccc1
Show InChI InChI=1S/C15H13N5O/c16-14-12(15(17)21)13(10-6-8-18-9-7-10)19-20(14)11-4-2-1-3-5-11/h1-9H,16H2,(H2,17,21)
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n/an/a 6.40E+4n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
VEGF-receptor 2 and tyrosine-protein kinase SRC


(Homo sapiens (Human))
BDBM50379225
PNG
(CHEMBL2011295 | US9416123, 9)
Show SMILES Nc1c(c(nn1-c1ccc(cc1)[N+]([O-])=O)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H14FN5O2/c21-15-3-1-13(2-4-15)18-19(14-9-11-23-12-10-14)24-25(20(18)22)16-5-7-17(8-6-16)26(27)28/h1-12H,22H2
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n/an/a 8.20E+4n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50379219
PNG
(CHEMBL2011303 | US9416123, 19)
Show SMILES Nc1cc(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1
Show InChI InChI=1S/C14H9Cl3N4/c15-9-5-10(16)14(11(17)6-9)21-13(18)7-12(20-21)8-1-3-19-4-2-8/h1-7H,18H2
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n/an/a 8.70E+4n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
B-RAF V600E


(Homo sapiens (Human))
BDBM50379220
PNG
(CHEMBL2011302 | US9416123, 16)
Show SMILES Nc1c(C(O)=O)c(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1
Show InChI InChI=1S/C15H9Cl3N4O2/c16-8-5-9(17)13(10(18)6-8)22-14(19)11(15(23)24)12(21-22)7-1-3-20-4-2-7/h1-6H,19H2,(H,23,24)
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n/an/a>1.00E+5n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50379221
PNG
(CHEMBL2011300 | US9416123, 15)
Show SMILES CCOC(=O)c1c(N)n(nc1-c1ccncc1)-c1c(Cl)cc(Cl)cc1Cl
Show InChI InChI=1S/C17H13Cl3N4O2/c1-2-26-17(25)13-14(9-3-5-22-6-4-9)23-24(16(13)21)15-11(19)7-10(18)8-12(15)20/h3-8H,2,21H2,1H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
VEGF-receptor 2 and tyrosine-protein kinase SRC


(Homo sapiens (Human))
BDBM50379221
PNG
(CHEMBL2011300 | US9416123, 15)
Show SMILES CCOC(=O)c1c(N)n(nc1-c1ccncc1)-c1c(Cl)cc(Cl)cc1Cl
Show InChI InChI=1S/C17H13Cl3N4O2/c1-2-26-17(25)13-14(9-3-5-22-6-4-9)23-24(16(13)21)15-11(19)7-10(18)8-12(15)20/h3-8H,2,21H2,1H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
VEGF-receptor 2 and tyrosine-protein kinase SRC


(Homo sapiens (Human))
BDBM50379219
PNG
(CHEMBL2011303 | US9416123, 19)
Show SMILES Nc1cc(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1
Show InChI InChI=1S/C14H9Cl3N4/c15-9-5-10(16)14(11(17)6-9)21-13(18)7-12(20-21)8-1-3-19-4-2-8/h1-7H,18H2
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n/an/a>1.00E+5n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
VEGF-receptor 2 and 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



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...


Citation and Details
More data for this
Ligand-Target Pair
B-RAF V600E


(Homo sapiens (Human))
BDBM50379219
PNG
(CHEMBL2011303 | US9416123, 19)
Show SMILES Nc1cc(nn1-c1c(Cl)cc(Cl)cc1Cl)-c1ccncc1
Show InChI InChI=1S/C14H9Cl3N4/c15-9-5-10(16)14(11(17)6-9)21-13(18)7-12(20-21)8-1-3-19-4-2-8/h1-7H,18H2
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n/an/a>1.00E+5n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
B-RAF V600E


(Homo sapiens (Human))
BDBM50379222
PNG
(CHEMBL2011299 | US9416123, 14)
Show SMILES NC(=O)c1c(N)n(nc1-c1ccncc1)-c1c(Cl)cc(Cl)cc1Cl
Show InChI InChI=1S/C15H10Cl3N5O/c16-8-5-9(17)13(10(18)6-8)23-14(19)11(15(20)24)12(22-23)7-1-3-21-4-2-7/h1-6H,19H2,(H2,20,24)
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n/an/a>1.00E+5n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
B-RAF V600E


(Homo sapiens (Human))
BDBM50379221
PNG
(CHEMBL2011300 | US9416123, 15)
Show SMILES CCOC(=O)c1c(N)n(nc1-c1ccncc1)-c1c(Cl)cc(Cl)cc1Cl
Show InChI InChI=1S/C17H13Cl3N4O2/c1-2-26-17(25)13-14(9-3-5-22-6-4-9)23-24(16(13)21)15-11(19)7-10(18)8-12(15)20/h3-8H,2,21H2,1H3
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US Patent
n/an/a>1.00E+5n/an/an/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%