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Compile Data Set for Download or QSAR

Found 47 hits Enz. Inhib. hit(s) with all data for entry = 50001685   
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
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM50021574
PNG
(BMS-907351 | CABOZANTINIB | CHEBI:72317 | Cabomety...)
Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)C4(CC4)C(=O)Nc4ccc(F)cc4)cc3)c2cc1OC
Show InChI InChI=1S/C28H24FN3O5/c1-35-24-15-21-22(16-25(24)36-2)30-14-11-23(21)37-20-9-7-19(8-10-20)32-27(34)28(12-13-28)26(33)31-18-5-3-17(29)4-6-18/h3-11,14-16H,12-13H2,1-2H3,(H,31,33)(H,32,34)
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n/an/a 0.480n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of KDR (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Macrophage-stimulating protein receptor


(Homo sapiens (Human))
BDBM50297394
PNG
(CHEMBL4171115)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4c(F)cccc4F)c(F)c3)ccnc2cc1OCCCN1CCCC1
Show InChI InChI=1S/C33H32F3N5O5S/c1-44-28-17-21-26(18-29(28)45-15-5-14-40-12-2-3-13-40)37-11-10-27(21)46-20-8-9-25(24(36)16-20)38-33(43)39-41-30(42)19-47-32(41)31-22(34)6-4-7-23(31)35/h4,6-11,16-18,32H,2-3,5,12-15,19H2,1H3,(H2,38,39,43)
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n/an/a 3.10n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of Ron (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Tyrosine-protein kinase receptor UFO


(Homo sapiens (Human))
BDBM50021574
PNG
(BMS-907351 | CABOZANTINIB | CHEBI:72317 | Cabomety...)
Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)C4(CC4)C(=O)Nc4ccc(F)cc4)cc3)c2cc1OC
Show InChI InChI=1S/C28H24FN3O5/c1-35-24-15-21-22(16-25(24)36-2)30-14-11-23(21)37-20-9-7-19(8-10-20)32-27(34)28(12-13-28)26(33)31-18-5-3-17(29)4-6-18/h3-11,14-16H,12-13H2,1-2H3,(H,31,33)(H,32,34)
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n/an/a 9.5n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of AXL (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50021574
PNG
(BMS-907351 | CABOZANTINIB | CHEBI:72317 | Cabomety...)
Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)C4(CC4)C(=O)Nc4ccc(F)cc4)cc3)c2cc1OC
Show InChI InChI=1S/C28H24FN3O5/c1-35-24-15-21-22(16-25(24)36-2)30-14-11-23(21)37-20-9-7-19(8-10-20)32-27(34)28(12-13-28)26(33)31-18-5-3-17(29)4-6-18/h3-11,14-16H,12-13H2,1-2H3,(H,31,33)(H,32,34)
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n/an/a 19n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50297394
PNG
(CHEMBL4171115)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4c(F)cccc4F)c(F)c3)ccnc2cc1OCCCN1CCCC1
Show InChI InChI=1S/C33H32F3N5O5S/c1-44-28-17-21-26(18-29(28)45-15-5-14-40-12-2-3-13-40)37-11-10-27(21)46-20-8-9-25(24(36)16-20)38-33(43)39-41-30(42)19-47-32(41)31-22(34)6-4-7-23(31)35/h4,6-11,16-18,32H,2-3,5,12-15,19H2,1H3,(H2,38,39,43)
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n/an/a 21n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM50297394
PNG
(CHEMBL4171115)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4c(F)cccc4F)c(F)c3)ccnc2cc1OCCCN1CCCC1
Show InChI InChI=1S/C33H32F3N5O5S/c1-44-28-17-21-26(18-29(28)45-15-5-14-40-12-2-3-13-40)37-11-10-27(21)46-20-8-9-25(24(36)16-20)38-33(43)39-41-30(42)19-47-32(41)31-22(34)6-4-7-23(31)35/h4,6-11,16-18,32H,2-3,5,12-15,19H2,1H3,(H2,38,39,43)
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n/an/a 21n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of KDR (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM50297394
PNG
(CHEMBL4171115)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4c(F)cccc4F)c(F)c3)ccnc2cc1OCCCN1CCCC1
Show InChI InChI=1S/C33H32F3N5O5S/c1-44-28-17-21-26(18-29(28)45-15-5-14-40-12-2-3-13-40)37-11-10-27(21)46-20-8-9-25(24(36)16-20)38-33(43)39-41-30(42)19-47-32(41)31-22(34)6-4-7-23(31)35/h4,6-11,16-18,32H,2-3,5,12-15,19H2,1H3,(H2,38,39,43)
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n/an/a 29n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of [125I]VCAM-Ig binding to VLA-4 of Jurkat cells in the presence of [Ca2+]


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50297565
PNG
(CHEMBL4160512)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4c(F)cccc4F)cc3F)ccnc2cc1OCCCN1CCCC1
Show InChI InChI=1S/C33H32F3N5O5S/c1-44-28-17-21-25(18-29(28)45-15-5-14-40-12-2-3-13-40)37-11-10-26(21)46-27-9-8-20(16-24(27)36)38-33(43)39-41-30(42)19-47-32(41)31-22(34)6-4-7-23(31)35/h4,6-11,16-18,32H,2-3,5,12-15,19H2,1H3,(H2,38,39,43)
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n/an/a 30n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
In vitro antiviral activity against HIV-1 Reverse transcriptase M184V mutant


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50297346
PNG
(CHEMBL4167741)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4c(F)cccc4F)cc3)ccnc2cc1OCCCN1CCCC1
Show InChI InChI=1S/C33H33F2N5O5S/c1-43-28-18-23-26(19-29(28)44-17-5-16-39-14-2-3-15-39)36-13-12-27(23)45-22-10-8-21(9-11-22)37-33(42)38-40-30(41)20-46-32(40)31-24(34)6-4-7-25(31)35/h4,6-13,18-19,32H,2-3,5,14-17,20H2,1H3,(H2,37,38,42)
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n/an/a 37n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM50021574
PNG
(BMS-907351 | CABOZANTINIB | CHEBI:72317 | Cabomety...)
Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)C4(CC4)C(=O)Nc4ccc(F)cc4)cc3)c2cc1OC
Show InChI InChI=1S/C28H24FN3O5/c1-35-24-15-21-22(16-25(24)36-2)30-14-11-23(21)37-20-9-7-19(8-10-20)32-27(34)28(12-13-28)26(33)31-18-5-3-17(29)4-6-18/h3-11,14-16H,12-13H2,1-2H3,(H,31,33)(H,32,34)
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n/an/a 37n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of RET (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50297285
PNG
(CHEMBL4161786)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4c(F)cccc4F)cc3)ccnc2cc1OCCCN1CCCCC1C
Show InChI InChI=1S/C35H37F2N5O5S/c1-22-7-3-4-16-41(22)17-6-18-46-31-20-28-25(19-30(31)45-2)29(14-15-38-28)47-24-12-10-23(11-13-24)39-35(44)40-42-32(43)21-48-34(42)33-26(36)8-5-9-27(33)37/h5,8-15,19-20,22,34H,3-4,6-7,16-18,21H2,1-2H3,(H2,39,40,44)
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n/an/a 46n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50296469
PNG
(CHEMBL4166652)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4c(F)cccc4F)cc3)ccnc2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C33H33F2N5O6S/c1-43-28-18-23-26(19-29(28)45-15-3-12-39-13-16-44-17-14-39)36-11-10-27(23)46-22-8-6-21(7-9-22)37-33(42)38-40-30(41)20-47-32(40)31-24(34)4-2-5-25(31)35/h2,4-11,18-19,32H,3,12-17,20H2,1H3,(H2,37,38,42)
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n/an/a 50n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM50021574
PNG
(BMS-907351 | CABOZANTINIB | CHEBI:72317 | Cabomety...)
Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)C4(CC4)C(=O)Nc4ccc(F)cc4)cc3)c2cc1OC
Show InChI InChI=1S/C28H24FN3O5/c1-35-24-15-21-22(16-25(24)36-2)30-14-11-23(21)37-20-9-7-19(8-10-20)32-27(34)28(12-13-28)26(33)31-18-5-3-17(29)4-6-18/h3-11,14-16H,12-13H2,1-2H3,(H,31,33)(H,32,34)
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n/an/a 53n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of c-Kit (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50297394
PNG
(CHEMBL4171115)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4c(F)cccc4F)c(F)c3)ccnc2cc1OCCCN1CCCC1
Show InChI InChI=1S/C33H32F3N5O5S/c1-44-28-17-21-26(18-29(28)45-15-5-14-40-12-2-3-13-40)37-11-10-27(21)46-20-8-9-25(24(36)16-20)38-33(43)39-41-30(42)19-47-32(41)31-22(34)6-4-7-23(31)35/h4,6-11,16-18,32H,2-3,5,12-15,19H2,1H3,(H2,38,39,43)
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n/an/a 61n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of Src (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50297158
PNG
(CHEMBL4175371)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4ccccc4F)cc3)ccnc2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C33H34FN5O6S/c1-42-29-19-25-27(20-30(29)44-16-4-13-38-14-17-43-18-15-38)35-12-11-28(25)45-23-9-7-22(8-10-23)36-33(41)37-39-31(40)21-46-32(39)24-5-2-3-6-26(24)34/h2-3,5-12,19-20,32H,4,13-18,21H2,1H3,(H2,36,37,41)
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n/an/a 61n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Tyrosine-protein kinase receptor UFO


(Homo sapiens (Human))
BDBM50297394
PNG
(CHEMBL4171115)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4c(F)cccc4F)c(F)c3)ccnc2cc1OCCCN1CCCC1
Show InChI InChI=1S/C33H32F3N5O5S/c1-44-28-17-21-26(18-29(28)45-15-5-14-40-12-2-3-13-40)37-11-10-27(21)46-20-8-9-25(24(36)16-20)38-33(43)39-41-30(42)19-47-32(41)31-22(34)6-4-7-23(31)35/h4,6-11,16-18,32H,2-3,5,12-15,19H2,1H3,(H2,38,39,43)
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n/an/a 62n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of AXL (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Macrophage-stimulating protein receptor


(Homo sapiens (Human))
BDBM50021574
PNG
(BMS-907351 | CABOZANTINIB | CHEBI:72317 | Cabomety...)
Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)C4(CC4)C(=O)Nc4ccc(F)cc4)cc3)c2cc1OC
Show InChI InChI=1S/C28H24FN3O5/c1-35-24-15-21-22(16-25(24)36-2)30-14-11-23(21)37-20-9-7-19(8-10-20)32-27(34)28(12-13-28)26(33)31-18-5-3-17(29)4-6-18/h3-11,14-16H,12-13H2,1-2H3,(H,31,33)(H,32,34)
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n/an/a 69n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of Ron (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50296409
PNG
(CHEMBL4163825)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4c(F)cc(F)cc4F)cc3)ccnc2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C33H32F3N5O6S/c1-44-28-17-23-26(18-29(28)46-12-2-9-40-10-13-45-14-11-40)37-8-7-27(23)47-22-5-3-21(4-6-22)38-33(43)39-41-30(42)19-48-32(41)31-24(35)15-20(34)16-25(31)36/h3-8,15-18,32H,2,9-14,19H2,1H3,(H2,38,39,43)
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n/an/a 94n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50297512
PNG
(CHEMBL4174964)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4ccccc4)cc3)ccnc2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C33H35N5O6S/c1-41-29-20-26-27(21-30(29)43-17-5-14-37-15-18-42-19-16-37)34-13-12-28(26)44-25-10-8-24(9-11-25)35-33(40)36-38-31(39)22-45-32(38)23-6-3-2-4-7-23/h2-4,6-13,20-21,32H,5,14-19,22H2,1H3,(H2,35,36,40)
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n/an/a 97n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50297344
PNG
(CHEMBL4175612)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4c(F)cccc4F)cc3)ccnc2cc1OCCCN1CC(C)CC(C)C1
Show InChI InChI=1S/C36H39F2N5O5S/c1-22-16-23(2)20-42(19-22)14-5-15-47-32-18-29-26(17-31(32)46-3)30(12-13-39-29)48-25-10-8-24(9-11-25)40-36(45)41-43-33(44)21-49-35(43)34-27(37)6-4-7-28(34)38/h4,6-13,17-18,22-23,35H,5,14-16,19-21H2,1-3H3,(H2,40,41,45)
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n/an/a 114n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM2579
PNG
((2S,3R,4R,6R)-3-methoxy-2-methyl-4-(methylamino)-2...)
Show SMILES CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r|
Show InChI InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20-,26-,28+/m1/s1
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n/an/a 128n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50297405
PNG
(CHEMBL4168185)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4ccc(F)cc4F)cc3)ccnc2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C33H33F2N5O6S/c1-43-29-18-25-27(19-30(29)45-14-2-11-39-12-15-44-16-13-39)36-10-9-28(25)46-23-6-4-22(5-7-23)37-33(42)38-40-31(41)20-47-32(40)24-8-3-21(34)17-26(24)35/h3-10,17-19,32H,2,11-16,20H2,1H3,(H2,37,38,42)
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n/an/a 141n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM50297394
PNG
(CHEMBL4171115)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4c(F)cccc4F)c(F)c3)ccnc2cc1OCCCN1CCCC1
Show InChI InChI=1S/C33H32F3N5O5S/c1-44-28-17-21-26(18-29(28)45-15-5-14-40-12-2-3-13-40)37-11-10-27(21)46-20-8-9-25(24(36)16-20)38-33(43)39-41-30(42)19-47-32(41)31-22(34)6-4-7-23(31)35/h4,6-11,16-18,32H,2-3,5,12-15,19H2,1H3,(H2,38,39,43)
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n/an/a 152n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of RET (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50296346
PNG
(CHEMBL4172427)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4c(F)cccc4F)cc3)ccnc2cc1OCCCN1CCSCC1
Show InChI InChI=1S/C33H33F2N5O5S2/c1-43-28-18-23-26(19-29(28)44-15-3-12-39-13-16-46-17-14-39)36-11-10-27(23)45-22-8-6-21(7-9-22)37-33(42)38-40-30(41)20-47-32(40)31-24(34)4-2-5-25(31)35/h2,4-11,18-19,32H,3,12-17,20H2,1H3,(H2,37,38,42)
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n/an/a 154n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50296407
PNG
(CHEMBL4160448)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4ccccc4Cl)cc3)ccnc2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C33H34ClN5O6S/c1-42-29-19-25-27(20-30(29)44-16-4-13-38-14-17-43-18-15-38)35-12-11-28(25)45-23-9-7-22(8-10-23)36-33(41)37-39-31(40)21-46-32(39)24-5-2-3-6-26(24)34/h2-3,5-12,19-20,32H,4,13-18,21H2,1H3,(H2,36,37,41)
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n/an/a 169n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50021574
PNG
(BMS-907351 | CABOZANTINIB | CHEBI:72317 | Cabomety...)
Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)C4(CC4)C(=O)Nc4ccc(F)cc4)cc3)c2cc1OC
Show InChI InChI=1S/C28H24FN3O5/c1-35-24-15-21-22(16-25(24)36-2)30-14-11-23(21)37-20-9-7-19(8-10-20)32-27(34)28(12-13-28)26(33)31-18-5-3-17(29)4-6-18/h3-11,14-16H,12-13H2,1-2H3,(H,31,33)(H,32,34)
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n/an/a 178n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of [125I]VCAM-Ig binding to VLA-4 of Jurkat cells in the presence of Mn2+


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50296471
PNG
(CHEMBL4160268)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4ccc(F)cc4)cc3)ccnc2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C33H34FN5O6S/c1-42-29-19-26-27(20-30(29)44-16-2-13-38-14-17-43-18-15-38)35-12-11-28(26)45-25-9-7-24(8-10-25)36-33(41)37-39-31(40)21-46-32(39)22-3-5-23(34)6-4-22/h3-12,19-20,32H,2,13-18,21H2,1H3,(H2,36,37,41)
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n/an/a 196n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50296399
PNG
(CHEMBL4175433)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(Cc5ccccc5)SCC4=O)cc3)ccnc2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C34H37N5O6S/c1-42-30-21-27-28(22-31(30)44-17-5-14-38-15-18-43-19-16-38)35-13-12-29(27)45-26-10-8-25(9-11-26)36-34(41)37-39-32(40)23-46-33(39)20-24-6-3-2-4-7-24/h2-4,6-13,21-22,33H,5,14-20,23H2,1H3,(H2,36,37,41)
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n/an/a 205n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50296750
PNG
(CHEMBL4164749)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4cccc(F)c4)cc3)ccnc2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C33H34FN5O6S/c1-42-29-19-26-27(20-30(29)44-15-3-12-38-13-16-43-17-14-38)35-11-10-28(26)45-25-8-6-24(7-9-25)36-33(41)37-39-31(40)21-46-32(39)22-4-2-5-23(34)18-22/h2,4-11,18-20,32H,3,12-17,21H2,1H3,(H2,36,37,41)
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n/an/a 308n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50296402
PNG
(CHEMBL4166841)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4ccncc4)cc3)ccnc2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C32H34N6O6S/c1-41-28-19-25-26(20-29(28)43-16-2-13-37-14-17-42-18-15-37)34-12-9-27(25)44-24-5-3-23(4-6-24)35-32(40)36-38-30(39)21-45-31(38)22-7-10-33-11-8-22/h3-12,19-20,31H,2,13-18,21H2,1H3,(H2,35,36,40)
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n/an/a 320n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50296398
PNG
(CHEMBL4164120)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(CCc5ccccc5)SCC4=O)cc3)ccnc2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C35H39N5O6S/c1-43-31-22-28-29(23-32(31)45-19-5-16-39-17-20-44-21-18-39)36-15-14-30(28)46-27-11-9-26(10-12-27)37-35(42)38-40-33(41)24-47-34(40)13-8-25-6-3-2-4-7-25/h2-4,6-7,9-12,14-15,22-23,34H,5,8,13,16-21,24H2,1H3,(H2,37,38,42)
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Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50296470
PNG
(CHEMBL4177280)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4ccc(F)c(F)c4)cc3)ccnc2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C33H33F2N5O6S/c1-43-29-18-24-27(19-30(29)45-14-2-11-39-12-15-44-16-13-39)36-10-9-28(24)46-23-6-4-22(5-7-23)37-33(42)38-40-31(41)20-47-32(40)21-3-8-25(34)26(35)17-21/h3-10,17-19,32H,2,11-16,20H2,1H3,(H2,37,38,42)
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Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50296408
PNG
(CHEMBL4168353)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4ccc(Cl)cc4)cc3)ccnc2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C33H34ClN5O6S/c1-42-29-19-26-27(20-30(29)44-16-2-13-38-14-17-43-18-15-38)35-12-11-28(26)45-25-9-7-24(8-10-25)36-33(41)37-39-31(40)21-46-32(39)22-3-5-23(34)6-4-22/h3-12,19-20,32H,2,13-18,21H2,1H3,(H2,36,37,41)
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n/an/a 348n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50296404
PNG
(CHEMBL4175145)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4ccccc4C(F)(F)F)cc3)ccnc2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C34H34F3N5O6S/c1-45-29-19-25-27(20-30(29)47-16-4-13-41-14-17-46-18-15-41)38-12-11-28(25)48-23-9-7-22(8-10-23)39-33(44)40-42-31(43)21-49-32(42)24-5-2-3-6-26(24)34(35,36)37/h2-3,5-12,19-20,32H,4,13-18,21H2,1H3,(H2,39,40,44)
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n/an/a 358n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50296403
PNG
(CHEMBL4167282)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4cccc(c4)C(F)(F)F)cc3)ccnc2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C34H34F3N5O6S/c1-45-29-19-26-27(20-30(29)47-15-3-12-41-13-16-46-17-14-41)38-11-10-28(26)48-25-8-6-24(7-9-25)39-33(44)40-42-31(43)21-49-32(42)22-4-2-5-23(18-22)34(35,36)37/h2,4-11,18-20,32H,3,12-17,21H2,1H3,(H2,39,40,44)
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n/an/a 415n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50296401
PNG
(CHEMBL4177459)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4ccc(cc4)N(C)C)cc3)ccnc2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C35H40N6O6S/c1-39(2)26-9-5-24(6-10-26)34-41(33(42)23-48-34)38-35(43)37-25-7-11-27(12-8-25)47-30-13-14-36-29-22-32(31(44-3)21-28(29)30)46-18-4-15-40-16-19-45-20-17-40/h5-14,21-22,34H,4,15-20,23H2,1-3H3,(H2,37,38,43)
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n/an/a 427n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50296405
PNG
(CHEMBL4170667)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4ccc(cc4)C(F)(F)F)cc3)ccnc2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C34H34F3N5O6S/c1-45-29-19-26-27(20-30(29)47-16-2-13-41-14-17-46-18-15-41)38-12-11-28(26)48-25-9-7-24(8-10-25)39-33(44)40-42-31(43)21-49-32(42)22-3-5-23(6-4-22)34(35,36)37/h3-12,19-20,32H,2,13-18,21H2,1H3,(H2,39,40,44)
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n/an/a 495n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50296410
PNG
(CHEMBL4171699)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4cc(F)c(F)c(F)c4)cc3)ccnc2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C33H32F3N5O6S/c1-44-28-17-23-26(18-29(28)46-12-2-9-40-10-13-45-14-11-40)37-8-7-27(23)47-22-5-3-21(4-6-22)38-33(43)39-41-30(42)19-48-32(41)20-15-24(34)31(36)25(35)16-20/h3-8,15-18,32H,2,9-14,19H2,1H3,(H2,38,39,43)
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n/an/a 580n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50296406
PNG
(CHEMBL4160024)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4cc(Cl)cc(Cl)c4)cc3)ccnc2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C33H33Cl2N5O6S/c1-43-29-18-26-27(19-30(29)45-12-2-9-39-10-13-44-14-11-39)36-8-7-28(26)46-25-5-3-24(4-6-25)37-33(42)38-40-31(41)20-47-32(40)21-15-22(34)17-23(35)16-21/h3-8,15-19,32H,2,9-14,20H2,1H3,(H2,37,38,42)
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n/an/a 658n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50296400
PNG
(CHEMBL4167564)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4ccc5ccccc5c4)cc3)ccnc2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C37H37N5O6S/c1-45-33-22-30-31(23-34(33)47-18-4-15-41-16-19-46-20-17-41)38-14-13-32(30)48-29-11-9-28(10-12-29)39-37(44)40-42-35(43)24-49-36(42)27-8-7-25-5-2-3-6-26(25)21-27/h2-3,5-14,21-23,36H,4,15-20,24H2,1H3,(H2,39,40,44)
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n/an/a 659n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of VLA-4 binding in Jurkat cells in the presence of Mg2+


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50296397
PNG
(CHEMBL4171989)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)C4CCCCC4)cc3)ccnc2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C33H41N5O6S/c1-41-29-20-26-27(21-30(29)43-17-5-14-37-15-18-42-19-16-37)34-13-12-28(26)44-25-10-8-24(9-11-25)35-33(40)36-38-31(39)22-45-32(38)23-6-3-2-4-7-23/h8-13,20-21,23,32H,2-7,14-19,22H2,1H3,(H2,35,36,40)
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n/an/a 688n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50297394
PNG
(CHEMBL4171115)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4c(F)cccc4F)c(F)c3)ccnc2cc1OCCCN1CCCC1
Show InChI InChI=1S/C33H32F3N5O5S/c1-44-28-17-21-26(18-29(28)45-15-5-14-40-12-2-3-13-40)37-11-10-27(21)46-20-8-9-25(24(36)16-20)38-33(43)39-41-30(42)19-47-32(41)31-22(34)6-4-7-23(31)35/h4,6-11,16-18,32H,2-3,5,12-15,19H2,1H3,(H2,38,39,43)
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n/an/a 812n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of EGFR (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50021574
PNG
(BMS-907351 | CABOZANTINIB | CHEBI:72317 | Cabomety...)
Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)C4(CC4)C(=O)Nc4ccc(F)cc4)cc3)c2cc1OC
Show InChI InChI=1S/C28H24FN3O5/c1-35-24-15-21-22(16-25(24)36-2)30-14-11-23(21)37-20-9-7-19(8-10-20)32-27(34)28(12-13-28)26(33)31-18-5-3-17(29)4-6-18/h3-11,14-16H,12-13H2,1-2H3,(H,31,33)(H,32,34)
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n/an/a 3.10E+3n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of EGFR (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50296349
PNG
(CHEMBL4160329)
Show SMILES COc1cc2c(Oc3ccc(cc3)C3SCC(=O)N3NC(=O)Nc3ccc(F)cc3F)ccnc2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C33H33F2N5O6S/c1-43-29-18-24-27(19-30(29)45-14-2-11-39-12-15-44-16-13-39)36-10-9-28(24)46-23-6-3-21(4-7-23)32-40(31(41)20-47-32)38-33(42)37-26-8-5-22(34)17-25(26)35/h3-10,17-19,32H,2,11-16,20H2,1H3,(H2,37,38,42)
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n/an/a 3.40E+3n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50296396
PNG
(CHEMBL4170935)
Show SMILES COc1cc2c(Oc3ccc(cc3)C3SCC(=O)N3NC(=O)Nc3ccccc3F)ccnc2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C33H34FN5O6S/c1-42-29-19-24-27(20-30(29)44-16-4-13-38-14-17-43-18-15-38)35-12-11-28(24)45-23-9-7-22(8-10-23)32-39(31(40)21-46-32)37-33(41)36-26-6-3-2-5-25(26)34/h2-3,5-12,19-20,32H,4,13-18,21H2,1H3,(H2,36,37,41)
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n/an/a 4.10E+3n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Insulin-like growth factor 1 receptor


(Homo sapiens (Human))
BDBM50297394
PNG
(CHEMBL4171115)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)NN4C(SCC4=O)c4c(F)cccc4F)c(F)c3)ccnc2cc1OCCCN1CCCC1
Show InChI InChI=1S/C33H32F3N5O5S/c1-44-28-17-21-26(18-29(28)45-15-5-14-40-12-2-3-13-40)37-11-10-27(21)46-20-8-9-25(24(36)16-20)38-33(43)39-41-30(42)19-47-32(41)31-22(34)6-4-7-23(31)35/h4,6-11,16-18,32H,2-3,5,12-15,19H2,1H3,(H2,38,39,43)
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n/an/a 4.70E+3n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of IGF1R (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair
Insulin-like growth factor 1 receptor


(Homo sapiens (Human))
BDBM50021574
PNG
(BMS-907351 | CABOZANTINIB | CHEBI:72317 | Cabomety...)
Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)C4(CC4)C(=O)Nc4ccc(F)cc4)cc3)c2cc1OC
Show InChI InChI=1S/C28H24FN3O5/c1-35-24-15-21-22(16-25(24)36-2)30-14-11-23(21)37-20-9-7-19(8-10-20)32-27(34)28(12-13-28)26(33)31-18-5-3-17(29)4-6-18/h3-11,14-16H,12-13H2,1-2H3,(H,31,33)(H,32,34)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Zhuhai Campus of Zunyi Medical University

Curated by ChEMBL


Assay Description
Inhibition of IGF1R (unknown origin) using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA


Eur J Med Chem 146: 368-380 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.061
BindingDB Entry DOI: 10.7270/Q2BP059Q
More data for this
Ligand-Target Pair