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PubMed code 25438768

Compile data set for download or QSAR
Found 44 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
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035354
PNG
(CHEMBL3343366)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C(F)(F)F)-c4ccc(F)cc4)cc3F)ccnc2cc1OCCCN1CCCC1
Show InChI InChI=1S/C33H29F5N6O4/c1-46-28-18-23-25(19-29(28)47-16-4-15-43-13-2-3-14-43)39-12-11-26(23)48-27-10-7-21(17-24(27)35)40-32(45)30-31(33(36,37)38)44(42-41-30)22-8-5-20(34)6-9-22/h5-12,17-19H,2-4,13-16H2,1H3,(H,40,45)
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n/an/a 1n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035339
PNG
(CHEMBL3343364)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C)-c4ccccc4)cc3F)ccnc2cc1OCCCN1CCCC1
Show InChI InChI=1S/C33H33FN6O4/c1-22-32(37-38-40(22)24-9-4-3-5-10-24)33(41)36-23-11-12-29(26(34)19-23)44-28-13-14-35-27-21-31(30(42-2)20-25(27)28)43-18-8-17-39-15-6-7-16-39/h3-5,9-14,19-21H,6-8,15-18H2,1-2H3,(H,36,41)
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n/an/a 1.60n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035395
PNG
(CHEMBL3343374)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C(F)(F)F)-c4ccc(F)cc4)cc3F)ccnc2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C33H29F5N6O5/c1-46-28-18-23-25(19-29(28)48-14-2-11-43-12-15-47-16-13-43)39-10-9-26(23)49-27-8-5-21(17-24(27)35)40-32(45)30-31(33(36,37)38)44(42-41-30)22-6-3-20(34)4-7-22/h3-10,17-19H,2,11-16H2,1H3,(H,40,45)
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n/an/a 1.80n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50399540
PNG
(FORETINIB)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)C4(CC4)C(=O)Nc4ccc(F)cc4)cc3F)ccnc2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C34H34F2N4O6/c1-43-30-20-25-27(21-31(30)45-16-2-13-40-14-17-44-18-15-40)37-12-9-28(25)46-29-8-7-24(19-26(29)36)39-33(42)34(10-11-34)32(41)38-23-5-3-22(35)4-6-23/h3-9,12,19-21H,2,10-11,13-18H2,1H3,(H,38,41)(H,39,42)
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n/an/a 1.80n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035408
PNG
(CHEMBL3343382)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C(F)(F)F)-c4ccc(F)cc4)cc3F)ccnc2cc1OCCCN1CCCCC1
Show InChI InChI=1S/C34H31F5N6O4/c1-47-29-19-24-26(20-30(29)48-17-5-16-44-14-3-2-4-15-44)40-13-12-27(24)49-28-11-8-22(18-25(28)36)41-33(46)31-32(34(37,38)39)45(43-42-31)23-9-6-21(35)7-10-23/h6-13,18-20H,2-5,14-17H2,1H3,(H,41,46)
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n/an/a 2n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035393
PNG
(CHEMBL3343372)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C)-c4ccccc4)cc3F)ccnc2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C33H33FN6O5/c1-22-32(37-38-40(22)24-7-4-3-5-8-24)33(41)36-23-9-10-29(26(34)19-23)45-28-11-12-35-27-21-31(30(42-2)20-25(27)28)44-16-6-13-39-14-17-43-18-15-39/h3-5,7-12,19-21H,6,13-18H2,1-2H3,(H,36,41)
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n/an/a 2.10n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035417
PNG
(CHEMBL3343390)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C(F)(F)F)-c4ccc(F)cc4)cc3F)ccnc2cc1OCCCN1CCC(C)CC1
Show InChI InChI=1S/C35H33F5N6O4/c1-21-11-15-45(16-12-21)14-3-17-49-31-20-27-25(19-30(31)48-2)28(10-13-41-27)50-29-9-6-23(18-26(29)37)42-34(47)32-33(35(38,39)40)46(44-43-32)24-7-4-22(36)5-8-24/h4-10,13,18-21H,3,11-12,14-17H2,1-2H3,(H,42,47)
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n/an/a 2.40n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035400
PNG
(CHEMBL3343377)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C(F)(F)F)-c4ccc(F)c(F)c4)cc3F)ccnc2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C33H28F6N6O5/c1-47-28-17-21-25(18-29(28)49-12-2-9-44-10-13-48-14-11-44)40-8-7-26(21)50-27-6-3-19(15-24(27)36)41-32(46)30-31(33(37,38)39)45(43-42-30)20-4-5-22(34)23(35)16-20/h3-8,15-18H,2,9-14H2,1H3,(H,41,46)
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Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035426
PNG
(CHEMBL3343399)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C(F)(F)F)-c4ccc(F)c(F)c4)cc3F)ccnc2cc1OCCCN1CCN(C)CC1
Show InChI InChI=1S/C34H31F6N7O4/c1-45-11-13-46(14-12-45)10-3-15-50-30-19-26-22(18-29(30)49-2)27(8-9-41-26)51-28-7-4-20(16-25(28)37)42-33(48)31-32(34(38,39)40)47(44-43-31)21-5-6-23(35)24(36)17-21/h4-9,16-19H,3,10-15H2,1-2H3,(H,42,48)
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Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035390
PNG
(CHEMBL3343369)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C(F)(F)F)-c4ccc(F)c(F)c4)cc3F)ccnc2cc1OCCCN1CCCC1
Show InChI InChI=1S/C33H28F6N6O4/c1-47-28-17-21-25(18-29(28)48-14-4-13-44-11-2-3-12-44)40-10-9-26(21)49-27-8-5-19(15-24(27)36)41-32(46)30-31(33(37,38)39)45(43-42-30)20-6-7-22(34)23(35)16-20/h5-10,15-18H,2-4,11-14H2,1H3,(H,41,46)
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n/an/a 3n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035411
PNG
(CHEMBL3343385)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C(F)(F)F)-c4ccc(F)c(F)c4)cc3F)ccnc2cc1OCCCN1CCCCC1
Show InChI InChI=1S/C34H30F6N6O4/c1-48-29-18-22-26(19-30(29)49-15-5-14-45-12-3-2-4-13-45)41-11-10-27(22)50-28-9-6-20(16-25(28)37)42-33(47)31-32(34(38,39)40)46(44-43-31)21-7-8-23(35)24(36)17-21/h6-11,16-19H,2-5,12-15H2,1H3,(H,42,47)
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n/an/a 3.10n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035404
PNG
(CHEMBL3343380)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C)-c4ccccc4)cc3F)ccnc2cc1OCCCN1CCCCC1
Show InChI InChI=1S/C34H35FN6O4/c1-23-33(38-39-41(23)25-10-5-3-6-11-25)34(42)37-24-12-13-30(27(35)20-24)45-29-14-15-36-28-22-32(31(43-2)21-26(28)29)44-19-9-18-40-16-7-4-8-17-40/h3,5-6,10-15,20-22H,4,7-9,16-19H2,1-2H3,(H,37,42)
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n/an/a 3.30n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035420
PNG
(CHEMBL3343393)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C(F)(F)F)-c4ccc(F)c(F)c4)cc3F)ccnc2cc1OCCCN1CCC(C)CC1
Show InChI InChI=1S/C35H32F6N6O4/c1-20-9-13-46(14-10-20)12-3-15-50-31-19-27-23(18-30(31)49-2)28(8-11-42-27)51-29-7-4-21(16-26(29)38)43-34(48)32-33(35(39,40)41)47(45-44-32)22-5-6-24(36)25(37)17-22/h4-8,11,16-20H,3,9-10,12-15H2,1-2H3,(H,43,48)
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n/an/a 3.30n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035414
PNG
(CHEMBL3343388)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C)-c4ccccc4)cc3F)ccnc2cc1OCCCN1CCC(C)CC1
Show InChI InChI=1S/C35H37FN6O4/c1-23-13-17-41(18-14-23)16-7-19-45-33-22-29-27(21-32(33)44-3)30(12-15-37-29)46-31-11-10-25(20-28(31)36)38-35(43)34-24(2)42(40-39-34)26-8-5-4-6-9-26/h4-6,8-12,15,20-23H,7,13-14,16-19H2,1-3H3,(H,38,43)
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Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035389
PNG
(CHEMBL3343368)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C(F)(F)F)-c4ccccc4C(F)(F)F)cc3F)ccnc2cc1OCCCN1CCCC1
Show InChI InChI=1S/C34H29F7N6O4/c1-49-28-18-21-24(19-29(28)50-16-6-15-46-13-4-5-14-46)42-12-11-26(21)51-27-10-9-20(17-23(27)35)43-32(48)30-31(34(39,40)41)47(45-44-30)25-8-3-2-7-22(25)33(36,37)38/h2-3,7-12,17-19H,4-6,13-16H2,1H3,(H,43,48)
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n/an/a 3.70n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035399
PNG
(CHEMBL3343376)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C(F)(F)F)-c4ccccc4C(F)(F)F)cc3F)ccnc2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C34H29F7N6O5/c1-49-28-18-21-24(19-29(28)51-14-4-11-46-12-15-50-16-13-46)42-10-9-26(21)52-27-8-7-20(17-23(27)35)43-32(48)30-31(34(39,40)41)47(45-44-30)25-6-3-2-5-22(25)33(36,37)38/h2-3,5-10,17-19H,4,11-16H2,1H3,(H,43,48)
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n/an/a 4n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM50035354
PNG
(CHEMBL3343366)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C(F)(F)F)-c4ccc(F)cc4)cc3F)ccnc2cc1OCCCN1CCCC1
Show InChI InChI=1S/C33H29F5N6O4/c1-46-28-18-23-25(19-29(28)47-16-4-15-43-13-2-3-14-43)39-12-11-26(23)48-27-10-7-21(17-24(27)35)40-32(45)30-31(33(36,37)38)44(42-41-30)22-8-5-20(34)6-9-22/h5-12,17-19H,2-4,13-16H2,1H3,(H,40,45)
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n/an/a 4n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Kit (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035410
PNG
(CHEMBL3343384)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C(F)(F)F)-c4ccccc4Cl)cc3F)ccnc2cc1OCCCN1CCCCC1
Show InChI InChI=1S/C34H31ClF4N6O4/c1-47-29-19-22-25(20-30(29)48-17-7-16-44-14-5-2-6-15-44)40-13-12-27(22)49-28-11-10-21(18-24(28)36)41-33(46)31-32(34(37,38)39)45(43-42-31)26-9-4-3-8-23(26)35/h3-4,8-13,18-20H,2,5-7,14-17H2,1H3,(H,41,46)
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n/an/a 4.10n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035349
PNG
(CHEMBL3343365)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C)-c4ccccc4C(F)(F)F)cc3F)ccnc2cc1OCCCN1CCCC1
Show InChI InChI=1S/C34H32F4N6O4/c1-21-32(41-42-44(21)27-9-4-3-8-24(27)34(36,37)38)33(45)40-22-10-11-29(25(35)18-22)48-28-12-13-39-26-20-31(30(46-2)19-23(26)28)47-17-7-16-43-14-5-6-15-43/h3-4,8-13,18-20H,5-7,14-17H2,1-2H3,(H,40,45)
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n/an/a 4.20n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035405
PNG
(CHEMBL3343381)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C)-c4ccccc4C(F)(F)F)cc3F)ccnc2cc1OCCCN1CCCCC1
Show InChI InChI=1S/C35H34F4N6O4/c1-22-33(42-43-45(22)28-10-5-4-9-25(28)35(37,38)39)34(46)41-23-11-12-30(26(36)19-23)49-29-13-14-40-27-21-32(31(47-2)20-24(27)29)48-18-8-17-44-15-6-3-7-16-44/h4-5,9-14,19-21H,3,6-8,15-18H2,1-2H3,(H,41,46)
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n/an/a 4.40n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035394
PNG
(CHEMBL3343373)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C)-c4ccccc4C(F)(F)F)cc3F)ccnc2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C34H32F4N6O5/c1-21-32(41-42-44(21)27-7-4-3-6-24(27)34(36,37)38)33(45)40-22-8-9-29(25(35)18-22)49-28-10-11-39-26-20-31(30(46-2)19-23(26)28)48-15-5-12-43-13-16-47-17-14-43/h3-4,6-11,18-20H,5,12-17H2,1-2H3,(H,40,45)
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n/an/a 4.70n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035419
PNG
(CHEMBL3343392)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C(F)(F)F)-c4ccccc4C(F)(F)F)cc3F)ccnc2cc1OCCCN1CCC(C)CC1
Show InChI InChI=1S/C36H33F7N6O4/c1-21-11-15-48(16-12-21)14-5-17-52-31-20-26-23(19-30(31)51-2)28(10-13-44-26)53-29-9-8-22(18-25(29)37)45-34(50)32-33(36(41,42)43)49(47-46-32)27-7-4-3-6-24(27)35(38,39)40/h3-4,6-10,13,18-21H,5,11-12,14-17H2,1-2H3,(H,45,50)
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n/an/a 4.90n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035423
PNG
(CHEMBL3343396)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C(F)(F)F)-c4ccccc4Cl)cc3F)ccnc2cc1OCCCN1CCN(C)CC1
Show InChI InChI=1S/C34H32ClF4N7O4/c1-44-13-15-45(16-14-44)12-5-17-49-30-20-25-22(19-29(30)48-2)27(10-11-40-25)50-28-9-8-21(18-24(28)36)41-33(47)31-32(34(37,38)39)46(43-42-31)26-7-4-3-6-23(26)35/h3-4,6-11,18-20H,5,12-17H2,1-2H3,(H,41,47)
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n/an/a 5n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035416
PNG
(CHEMBL3343389)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C)-c4ccccc4C(F)(F)F)cc3F)ccnc2cc1OCCCN1CCC(C)CC1
Show InChI InChI=1S/C36H36F4N6O4/c1-22-12-16-45(17-13-22)15-6-18-49-33-21-28-25(20-32(33)48-3)30(11-14-41-28)50-31-10-9-24(19-27(31)37)42-35(47)34-23(2)46(44-43-34)29-8-5-4-7-26(29)36(38,39)40/h4-5,7-11,14,19-22H,6,12-13,15-18H2,1-3H3,(H,42,47)
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n/an/a 5.10n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035425
PNG
(CHEMBL3343398)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C(F)(F)F)-c4ccccc4C(F)(F)F)cc3F)ccnc2cc1OCCCN1CCN(C)CC1
Show InChI InChI=1S/C35H32F7N7O4/c1-47-13-15-48(16-14-47)12-5-17-52-30-20-25-22(19-29(30)51-2)27(10-11-43-25)53-28-9-8-21(18-24(28)36)44-33(50)31-32(35(40,41)42)49(46-45-31)26-7-4-3-6-23(26)34(37,38)39/h3-4,6-11,18-20H,5,12-17H2,1-2H3,(H,44,50)
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n/an/a 5.10n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035422
PNG
(CHEMBL3343395)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C)-c4ccccc4C(F)(F)F)cc3F)ccnc2cc1OCCCN1CCN(C)CC1
Show InChI InChI=1S/C35H35F4N7O4/c1-22-33(42-43-46(22)28-8-5-4-7-25(28)35(37,38)39)34(47)41-23-9-10-30(26(36)19-23)50-29-11-12-40-27-21-32(31(48-3)20-24(27)29)49-18-6-13-45-16-14-44(2)15-17-45/h4-5,7-12,19-21H,6,13-18H2,1-3H3,(H,41,47)
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n/an/a 5.20n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035421
PNG
(CHEMBL3343394)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C(F)(F)F)-c4cccc(Br)c4)cc3F)ccnc2cc1OCCCN1CCC(C)CC1
Show InChI InChI=1S/C35H33BrF4N6O4/c1-21-10-14-45(15-11-21)13-4-16-49-31-20-27-25(19-30(31)48-2)28(9-12-41-27)50-29-8-7-23(18-26(29)37)42-34(47)32-33(35(38,39)40)46(44-43-32)24-6-3-5-22(36)17-24/h3,5-9,12,17-21H,4,10-11,13-16H2,1-2H3,(H,42,47)
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n/an/a 5.30n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035298
PNG
(CHEMBL3343363)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C)-c4ccccc4C)cc3F)ccnc2cc1OCCCN1CCCC1
Show InChI InChI=1S/C34H35FN6O4/c1-22-9-4-5-10-28(22)41-23(2)33(38-39-41)34(42)37-24-11-12-30(26(35)19-24)45-29-13-14-36-27-21-32(31(43-3)20-25(27)29)44-18-8-17-40-15-6-7-16-40/h4-5,9-14,19-21H,6-8,15-18H2,1-3H3,(H,37,42)
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n/an/a 8.5n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Tyrosine-protein kinase receptor FLT3


(Homo sapiens (Human))
BDBM50035354
PNG
(CHEMBL3343366)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C(F)(F)F)-c4ccc(F)cc4)cc3F)ccnc2cc1OCCCN1CCCC1
Show InChI InChI=1S/C33H29F5N6O4/c1-46-28-18-23-25(19-29(28)47-16-4-15-43-13-2-3-14-43)39-12-11-26(23)48-27-10-7-21(17-24(27)35)40-32(45)30-31(33(36,37)38)44(42-41-30)22-8-5-20(34)6-9-22/h5-12,17-19H,2-4,13-16H2,1H3,(H,40,45)
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n/an/a 8.80n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of FLT3 (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035387
PNG
(CHEMBL3343367)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C(F)(F)F)-c4ccc(C)cc4)cc3F)ccnc2cc1OCCCN1CCCC1
Show InChI InChI=1S/C34H32F4N6O4/c1-21-6-9-23(10-7-21)44-32(34(36,37)38)31(41-42-44)33(45)40-22-8-11-28(25(35)18-22)48-27-12-13-39-26-20-30(29(46-2)19-24(26)27)47-17-5-16-43-14-3-4-15-43/h6-13,18-20H,3-5,14-17H2,1-2H3,(H,40,45)
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n/an/a 8.90n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035392
PNG
(CHEMBL3343371)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C)-c4ccccc4C)cc3F)ccnc2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C34H35FN6O5/c1-22-7-4-5-8-28(22)41-23(2)33(38-39-41)34(42)37-24-9-10-30(26(35)19-24)46-29-11-12-36-27-21-32(31(43-3)20-25(27)29)45-16-6-13-40-14-17-44-18-15-40/h4-5,7-12,19-21H,6,13-18H2,1-3H3,(H,37,42)
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n/an/a 10n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035396
PNG
(CHEMBL3343375)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C(F)(F)F)-c4ccc(C)cc4)cc3F)ccnc2cc1OCCCN1CCOCC1
Show InChI InChI=1S/C34H32F4N6O5/c1-21-4-7-23(8-5-21)44-32(34(36,37)38)31(41-42-44)33(45)40-22-6-9-28(25(35)18-22)49-27-10-11-39-26-20-30(29(46-2)19-24(26)27)48-15-3-12-43-13-16-47-17-14-43/h4-11,18-20H,3,12-17H2,1-2H3,(H,40,45)
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n/an/a 11n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035409
PNG
(CHEMBL3343383)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C(F)(F)F)-c4ccc(C)cc4)cc3F)ccnc2cc1OCCCN1CCCCC1
Show InChI InChI=1S/C35H34F4N6O4/c1-22-7-10-24(11-8-22)45-33(35(37,38)39)32(42-43-45)34(46)41-23-9-12-29(26(36)19-23)49-28-13-14-40-27-21-31(30(47-2)20-25(27)28)48-18-6-17-44-15-4-3-5-16-44/h7-14,19-21H,3-6,15-18H2,1-2H3,(H,41,46)
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n/an/a 13n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035402
PNG
(CHEMBL3343379)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C)-c4ccccc4C)cc3F)ccnc2cc1OCCCN1CCCCC1
Show InChI InChI=1S/C35H37FN6O4/c1-23-10-5-6-11-29(23)42-24(2)34(39-40-42)35(43)38-25-12-13-31(27(36)20-25)46-30-14-15-37-28-22-33(32(44-3)21-26(28)30)45-19-9-18-41-16-7-4-8-17-41/h5-6,10-15,20-22H,4,7-9,16-19H2,1-3H3,(H,38,43)
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n/an/a 13n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035418
PNG
(CHEMBL3343391)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C(F)(F)F)-c4ccc(C)cc4)cc3F)ccnc2cc1OCCCN1CCC(C)CC1
Show InChI InChI=1S/C36H36F4N6O4/c1-22-5-8-25(9-6-22)46-34(36(38,39)40)33(43-44-46)35(47)42-24-7-10-30(27(37)19-24)50-29-11-14-41-28-21-32(31(48-3)20-26(28)29)49-18-4-15-45-16-12-23(2)13-17-45/h5-11,14,19-21,23H,4,12-13,15-18H2,1-3H3,(H,42,47)
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n/an/a 14n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035413
PNG
(CHEMBL3343387)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C)-c4ccccc4C)cc3F)ccnc2cc1OCCCN1CCC(C)CC1
Show InChI InChI=1S/C36H39FN6O4/c1-23-13-17-42(18-14-23)16-7-19-46-34-22-29-27(21-33(34)45-4)31(12-15-38-29)47-32-11-10-26(20-28(32)37)39-36(44)35-25(3)43(41-40-35)30-9-6-5-8-24(30)2/h5-6,8-12,15,20-23H,7,13-14,16-19H2,1-4H3,(H,39,44)
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n/an/a 14n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035391
PNG
(CHEMBL3343370)
Show SMILES COc1ccc(cc1)-n1nnc(C(=O)Nc2ccc(Oc3ccnc4cc(OCCCN5CCCC5)c(OC)cc34)c(F)c2)c1C(F)(F)F
Show InChI InChI=1S/C34H32F4N6O5/c1-46-23-9-7-22(8-10-23)44-32(34(36,37)38)31(41-42-44)33(45)40-21-6-11-28(25(35)18-21)49-27-12-13-39-26-20-30(29(47-2)19-24(26)27)48-17-5-16-43-14-3-4-15-43/h6-13,18-20H,3-5,14-17H2,1-2H3,(H,40,45)
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n/an/a 15n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035424
PNG
(CHEMBL3343397)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C(F)(F)F)-c4ccc(C)cc4)cc3F)ccnc2cc1OCCCN1CCN(C)CC1
Show InChI InChI=1S/C35H35F4N7O4/c1-22-5-8-24(9-6-22)46-33(35(37,38)39)32(42-43-46)34(47)41-23-7-10-29(26(36)19-23)50-28-11-12-40-27-21-31(30(48-3)20-25(27)28)49-18-4-13-45-16-14-44(2)15-17-45/h5-12,19-21H,4,13-18H2,1-3H3,(H,41,47)
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n/an/a 15n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50035354
PNG
(CHEMBL3343366)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C(F)(F)F)-c4ccc(F)cc4)cc3F)ccnc2cc1OCCCN1CCCC1
Show InChI InChI=1S/C33H29F5N6O4/c1-46-28-18-23-25(19-29(28)47-16-4-15-43-13-2-3-14-43)39-12-11-26(23)48-27-10-7-21(17-24(27)35)40-32(45)30-31(33(36,37)38)44(42-41-30)22-8-5-20(34)6-9-22/h5-12,17-19H,2-4,13-16H2,1H3,(H,40,45)
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n/an/a 16n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of PDGFRbeta (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035401
PNG
(CHEMBL3343378)
Show SMILES COc1ccc(cc1)-n1nnc(C(=O)Nc2ccc(Oc3ccnc4cc(OCCCN5CCOCC5)c(OC)cc34)c(F)c2)c1C(F)(F)F
Show InChI InChI=1S/C34H32F4N6O6/c1-46-23-7-5-22(6-8-23)44-32(34(36,37)38)31(41-42-44)33(45)40-21-4-9-28(25(35)18-21)50-27-10-11-39-26-20-30(29(47-2)19-24(26)27)49-15-3-12-43-13-16-48-17-14-43/h4-11,18-20H,3,12-17H2,1-2H3,(H,40,45)
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n/an/a 17n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035412
PNG
(CHEMBL3343386)
Show SMILES COc1ccc(cc1)-n1nnc(C(=O)Nc2ccc(Oc3ccnc4cc(OCCCN5CCCCC5)c(OC)cc34)c(F)c2)c1C(F)(F)F
Show InChI InChI=1S/C35H34F4N6O5/c1-47-24-10-8-23(9-11-24)45-33(35(37,38)39)32(42-43-45)34(46)41-22-7-12-29(26(36)19-22)50-28-13-14-40-27-21-31(30(48-2)20-25(27)28)49-18-6-17-44-15-4-3-5-16-44/h7-14,19-21H,3-6,15-18H2,1-2H3,(H,41,46)
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n/an/a 19n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM50035427
PNG
(CHEMBL3343400)
Show SMILES COc1ccc(cc1)-n1nnc(C(=O)Nc2ccc(Oc3ccnc4cc(OCCCN5CCN(C)CC5)c(OC)cc34)c(F)c2)c1C(F)(F)F
Show InChI InChI=1S/C35H35F4N7O5/c1-44-14-16-45(17-15-44)13-4-18-50-31-21-27-25(20-30(31)49-3)28(11-12-40-27)51-29-10-5-22(19-26(29)36)41-34(47)32-33(35(37,38)39)46(43-42-32)23-6-8-24(48-2)9-7-23/h5-12,19-21H,4,13-18H2,1-3H3,(H,41,47)
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n/an/a 25n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50035354
PNG
(CHEMBL3343366)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C(F)(F)F)-c4ccc(F)cc4)cc3F)ccnc2cc1OCCCN1CCCC1
Show InChI InChI=1S/C33H29F5N6O4/c1-46-28-18-23-25(19-29(28)47-16-4-15-43-13-2-3-14-43)39-12-11-26(23)48-27-10-7-21(17-24(27)35)40-32(45)30-31(33(36,37)38)44(42-41-30)22-8-5-20(34)6-9-22/h5-12,17-19H,2-4,13-16H2,1H3,(H,40,45)
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n/an/a 65n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of KDR (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50035354
PNG
(CHEMBL3343366)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nnn(c4C(F)(F)F)-c4ccc(F)cc4)cc3F)ccnc2cc1OCCCN1CCCC1
Show InChI InChI=1S/C33H29F5N6O4/c1-46-28-18-23-25(19-29(28)47-16-4-15-43-13-2-3-14-43)39-12-11-26(23)48-27-10-7-21(17-24(27)35)40-32(45)30-31(33(36,37)38)44(42-41-30)22-8-5-20(34)6-9-22/h5-12,17-19H,2-4,13-16H2,1H3,(H,40,45)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of EGFR (unknown origin) using poly (Glu, Tyr) 4:1 substrate incubated for 30 mins by HTRF assay


Bioorg Med Chem 22: 6438-52 (2014)


Article DOI: 10.1016/j.bmc.2014.09.037
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%