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PubMed code 18311895

Compile data set for download or QSAR
Found 27 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
Tyrosine-protein kinase Yes


(Homo sapiens (Human))
BDBM50221566
PNG
(4-chloro-3-(5-methyl-3-(4-(2-(pyrrolidin-1-yl)etho...)
Show SMILES Cc1cc(cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc12)-c1cc(O)ccc1Cl
Show InChI InChI=1S/C26H26ClN5O2/c1-17-14-18(22-16-20(33)6-9-23(22)27)15-24-25(17)29-26(31-30-24)28-19-4-7-21(8-5-19)34-13-12-32-10-2-3-11-32/h4-9,14-16,33H,2-3,10-13H2,1H3,(H,28,29,31)
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PubMed
n/an/a 0.300n/an/an/an/an/an/a



TargeGen Inc.

Curated by ChEMBL


Assay Description
Inhibition of YES


J Med Chem 51: 1546-59 (2008)


Article DOI: 10.1021/jm7011276
BindingDB Entry DOI: 10.7270/Q2NV9K3X
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Yes


(Homo sapiens (Human))
BDBM50193874
PNG
(7-(2,6-dimethylphenyl)-5-methyl-N-(4-(2-(pyrrolidi...)
Show SMILES Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccc(OCCN4CCCC4)cc3)nnc2c1
Show InChI InChI=1S/C28H31N5O/c1-19-7-6-8-20(2)26(19)22-17-21(3)27-25(18-22)31-32-28(30-27)29-23-9-11-24(12-10-23)34-16-15-33-13-4-5-14-33/h6-12,17-18H,4-5,13-16H2,1-3H3,(H,29,30,32)
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n/an/a 1.20n/an/an/an/an/an/a



TargeGen Inc.

Curated by ChEMBL


Assay Description
Inhibition of YES


J Med Chem 51: 1546-59 (2008)


Article DOI: 10.1021/jm7011276
BindingDB Entry DOI: 10.7270/Q2NV9K3X
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Yes


(Homo sapiens (Human))
BDBM50221553
PNG
(4-(7-(2-chloro-5-hydroxyphenyl)-5-methylbenzo[e][1...)
Show SMILES Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc12)-c1cc(O)ccc1Cl
Show InChI InChI=1S/C26H27ClN6O3S/c1-17-14-18(22-16-20(34)6-9-23(22)27)15-24-25(17)30-26(32-31-24)29-19-4-7-21(8-5-19)37(35,36)28-10-13-33-11-2-3-12-33/h4-9,14-16,28,34H,2-3,10-13H2,1H3,(H,29,30,32)
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n/an/a 1.30n/an/an/an/an/an/a



TargeGen Inc.

Curated by ChEMBL


Assay Description
Inhibition of YES


J Med Chem 51: 1546-59 (2008)


Article DOI: 10.1021/jm7011276
BindingDB Entry DOI: 10.7270/Q2NV9K3X
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50221547
PNG
(4-chloro-3-(5-methyl-3-(4-(3-(pyrrolidin-1-yl)prop...)
Show SMILES Cc1cc(cc2nnc(Nc3ccc(CCCN4CCCC4)cc3)nc12)-c1cc(O)ccc1Cl
Show InChI InChI=1S/C27H28ClN5O/c1-18-15-20(23-17-22(34)10-11-24(23)28)16-25-26(18)30-27(32-31-25)29-21-8-6-19(7-9-21)5-4-14-33-12-2-3-13-33/h6-11,15-17,34H,2-5,12-14H2,1H3,(H,29,30,32)
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n/an/a 1.5n/an/an/an/an/an/a



TargeGen Inc.

Curated by ChEMBL


Assay Description
Inhibition of Src


J Med Chem 51: 1546-59 (2008)


Article DOI: 10.1021/jm7011276
BindingDB Entry DOI: 10.7270/Q2NV9K3X
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50221556
PNG
(4-chloro-3-(5-methyl-3-(4-(piperidin-4-ylsulfonyl)...)
Show SMILES Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)C3CCNCC3)nc12)-c1cc(O)ccc1Cl
Show InChI InChI=1S/C25H24ClN5O3S/c1-15-12-16(21-14-18(32)4-7-22(21)26)13-23-24(15)29-25(31-30-23)28-17-2-5-19(6-3-17)35(33,34)20-8-10-27-11-9-20/h2-7,12-14,20,27,32H,8-11H2,1H3,(H,28,29,31)
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n/an/a 1.70n/an/an/an/an/an/a



TargeGen Inc.

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2


J Med Chem 51: 1546-59 (2008)


Article DOI: 10.1021/jm7011276
BindingDB Entry DOI: 10.7270/Q2NV9K3X
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50221566
PNG
(4-chloro-3-(5-methyl-3-(4-(2-(pyrrolidin-1-yl)etho...)
Show SMILES Cc1cc(cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc12)-c1cc(O)ccc1Cl
Show InChI InChI=1S/C26H26ClN5O2/c1-17-14-18(22-16-20(33)6-9-23(22)27)15-24-25(17)29-26(31-30-24)28-19-4-7-21(8-5-19)34-13-12-32-10-2-3-11-32/h4-9,14-16,33H,2-3,10-13H2,1H3,(H,28,29,31)
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n/an/a 1.80n/an/an/an/an/an/a



TargeGen Inc.

Curated by ChEMBL


Assay Description
Inhibition of Src


J Med Chem 51: 1546-59 (2008)


Article DOI: 10.1021/jm7011276
BindingDB Entry DOI: 10.7270/Q2NV9K3X
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50221566
PNG
(4-chloro-3-(5-methyl-3-(4-(2-(pyrrolidin-1-yl)etho...)
Show SMILES Cc1cc(cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc12)-c1cc(O)ccc1Cl
Show InChI InChI=1S/C26H26ClN5O2/c1-17-14-18(22-16-20(33)6-9-23(22)27)15-24-25(17)29-26(31-30-24)28-19-4-7-21(8-5-19)34-13-12-32-10-2-3-11-32/h4-9,14-16,33H,2-3,10-13H2,1H3,(H,28,29,31)
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n/an/a 2.20n/an/an/an/an/an/a



TargeGen Inc.

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2


J Med Chem 51: 1546-59 (2008)


Article DOI: 10.1021/jm7011276
BindingDB Entry DOI: 10.7270/Q2NV9K3X
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50221547
PNG
(4-chloro-3-(5-methyl-3-(4-(3-(pyrrolidin-1-yl)prop...)
Show SMILES Cc1cc(cc2nnc(Nc3ccc(CCCN4CCCC4)cc3)nc12)-c1cc(O)ccc1Cl
Show InChI InChI=1S/C27H28ClN5O/c1-18-15-20(23-17-22(34)10-11-24(23)28)16-25-26(18)30-27(32-31-25)29-21-8-6-19(7-9-21)5-4-14-33-12-2-3-13-33/h6-11,15-17,34H,2-5,12-14H2,1H3,(H,29,30,32)
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n/an/a 2.70n/an/an/an/an/an/a



TargeGen Inc.

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2


J Med Chem 51: 1546-59 (2008)


Article DOI: 10.1021/jm7011276
BindingDB Entry DOI: 10.7270/Q2NV9K3X
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50221553
PNG
(4-(7-(2-chloro-5-hydroxyphenyl)-5-methylbenzo[e][1...)
Show SMILES Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc12)-c1cc(O)ccc1Cl
Show InChI InChI=1S/C26H27ClN6O3S/c1-17-14-18(22-16-20(34)6-9-23(22)27)15-24-25(17)30-26(32-31-24)29-19-4-7-21(8-5-19)37(35,36)28-10-13-33-11-2-3-12-33/h4-9,14-16,28,34H,2-3,10-13H2,1H3,(H,29,30,32)
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n/an/a 3.60n/an/an/an/an/an/a



TargeGen Inc.

Curated by ChEMBL


Assay Description
Inhibition of Src


J Med Chem 51: 1546-59 (2008)


Article DOI: 10.1021/jm7011276
BindingDB Entry DOI: 10.7270/Q2NV9K3X
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50221563
PNG
((4-(7-(2-chloro-5-hydroxyphenyl)-5-methylbenzo[e][...)
Show SMILES Cc1cc(cc2nnc(Nc3ccc(cc3)C(=O)N3CCNCC3)nc12)-c1cc(O)ccc1Cl
Show InChI InChI=1S/C25H23ClN6O2/c1-15-12-17(20-14-19(33)6-7-21(20)26)13-22-23(15)29-25(31-30-22)28-18-4-2-16(3-5-18)24(34)32-10-8-27-9-11-32/h2-7,12-14,27,33H,8-11H2,1H3,(H,28,29,31)
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n/an/a 3.60n/an/an/an/an/an/a



TargeGen Inc.

Curated by ChEMBL


Assay Description
Inhibition of Src


J Med Chem 51: 1546-59 (2008)


Article DOI: 10.1021/jm7011276
BindingDB Entry DOI: 10.7270/Q2NV9K3X
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Yes


(Homo sapiens (Human))
BDBM50221556
PNG
(4-chloro-3-(5-methyl-3-(4-(piperidin-4-ylsulfonyl)...)
Show SMILES Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)C3CCNCC3)nc12)-c1cc(O)ccc1Cl
Show InChI InChI=1S/C25H24ClN5O3S/c1-15-12-16(21-14-18(32)4-7-22(21)26)13-23-24(15)29-25(31-30-23)28-17-2-5-19(6-3-17)35(33,34)20-8-10-27-11-9-20/h2-7,12-14,20,27,32H,8-11H2,1H3,(H,28,29,31)
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n/an/a 4.10n/an/an/an/an/an/a



TargeGen Inc.

Curated by ChEMBL


Assay Description
Inhibition of YES


J Med Chem 51: 1546-59 (2008)


Article DOI: 10.1021/jm7011276
BindingDB Entry DOI: 10.7270/Q2NV9K3X
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50221553
PNG
(4-(7-(2-chloro-5-hydroxyphenyl)-5-methylbenzo[e][1...)
Show SMILES Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)NCCN3CCCC3)nc12)-c1cc(O)ccc1Cl
Show InChI InChI=1S/C26H27ClN6O3S/c1-17-14-18(22-16-20(34)6-9-23(22)27)15-24-25(17)30-26(32-31-24)29-19-4-7-21(8-5-19)37(35,36)28-10-13-33-11-2-3-12-33/h4-9,14-16,28,34H,2-3,10-13H2,1H3,(H,29,30,32)
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n/an/a 4.70n/an/an/an/an/an/a



TargeGen Inc.

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2


J Med Chem 51: 1546-59 (2008)


Article DOI: 10.1021/jm7011276
BindingDB Entry DOI: 10.7270/Q2NV9K3X
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Yes


(Homo sapiens (Human))
BDBM50221547
PNG
(4-chloro-3-(5-methyl-3-(4-(3-(pyrrolidin-1-yl)prop...)
Show SMILES Cc1cc(cc2nnc(Nc3ccc(CCCN4CCCC4)cc3)nc12)-c1cc(O)ccc1Cl
Show InChI InChI=1S/C27H28ClN5O/c1-18-15-20(23-17-22(34)10-11-24(23)28)16-25-26(18)30-27(32-31-25)29-21-8-6-19(7-9-21)5-4-14-33-12-2-3-13-33/h6-11,15-17,34H,2-5,12-14H2,1H3,(H,29,30,32)
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n/an/a 4.80n/an/an/an/an/an/a



TargeGen Inc.

Curated by ChEMBL


Assay Description
Inhibition of YES


J Med Chem 51: 1546-59 (2008)


Article DOI: 10.1021/jm7011276
BindingDB Entry DOI: 10.7270/Q2NV9K3X
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Yes


(Homo sapiens (Human))
BDBM50221563
PNG
((4-(7-(2-chloro-5-hydroxyphenyl)-5-methylbenzo[e][...)
Show SMILES Cc1cc(cc2nnc(Nc3ccc(cc3)C(=O)N3CCNCC3)nc12)-c1cc(O)ccc1Cl
Show InChI InChI=1S/C25H23ClN6O2/c1-15-12-17(20-14-19(33)6-7-21(20)26)13-22-23(15)29-25(31-30-22)28-18-4-2-16(3-5-18)24(34)32-10-8-27-9-11-32/h2-7,12-14,27,33H,8-11H2,1H3,(H,28,29,31)
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n/an/a 5.20n/an/an/an/an/an/a



TargeGen Inc.

Curated by ChEMBL


Assay Description
Inhibition of YES


J Med Chem 51: 1546-59 (2008)


Article DOI: 10.1021/jm7011276
BindingDB Entry DOI: 10.7270/Q2NV9K3X
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50221556
PNG
(4-chloro-3-(5-methyl-3-(4-(piperidin-4-ylsulfonyl)...)
Show SMILES Cc1cc(cc2nnc(Nc3ccc(cc3)S(=O)(=O)C3CCNCC3)nc12)-c1cc(O)ccc1Cl
Show InChI InChI=1S/C25H24ClN5O3S/c1-15-12-16(21-14-18(32)4-7-22(21)26)13-23-24(15)29-25(31-30-23)28-17-2-5-19(6-3-17)35(33,34)20-8-10-27-11-9-20/h2-7,12-14,20,27,32H,8-11H2,1H3,(H,28,29,31)
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n/an/a 5.20n/an/an/an/an/an/a



TargeGen Inc.

Curated by ChEMBL


Assay Description
Inhibition of Src


J Med Chem 51: 1546-59 (2008)


Article DOI: 10.1021/jm7011276
BindingDB Entry DOI: 10.7270/Q2NV9K3X
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50193874
PNG
(7-(2,6-dimethylphenyl)-5-methyl-N-(4-(2-(pyrrolidi...)
Show SMILES Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccc(OCCN4CCCC4)cc3)nnc2c1
Show InChI InChI=1S/C28H31N5O/c1-19-7-6-8-20(2)26(19)22-17-21(3)27-25(18-22)31-32-28(30-27)29-23-9-11-24(12-10-23)34-16-15-33-13-4-5-14-33/h6-12,17-18H,4-5,13-16H2,1-3H3,(H,29,30,32)
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n/an/a 7n/an/an/an/an/an/a



TargeGen Inc.

Curated by ChEMBL


Assay Description
Inhibition of Src


J Med Chem 51: 1546-59 (2008)


Article DOI: 10.1021/jm7011276
BindingDB Entry DOI: 10.7270/Q2NV9K3X
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Yes


(Homo sapiens (Human))
BDBM50198782
PNG
(([7-(2,6-dichloro-phenyl)-5-methyl-benzo[1,2,4]tri...)
Show SMILES Cc1cc(cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc12)-c1c(Cl)cccc1Cl
Show InChI InChI=1S/C26H25Cl2N5O/c1-17-15-18(24-21(27)5-4-6-22(24)28)16-23-25(17)30-26(32-31-23)29-19-7-9-20(10-8-19)34-14-13-33-11-2-3-12-33/h4-10,15-16H,2-3,11-14H2,1H3,(H,29,30,32)
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n/an/a 10n/an/an/an/an/an/a



TargeGen Inc.

Curated by ChEMBL


Assay Description
Inhibition of YES


J Med Chem 51: 1546-59 (2008)


Article DOI: 10.1021/jm7011276
BindingDB Entry DOI: 10.7270/Q2NV9K3X
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50198782
PNG
(([7-(2,6-dichloro-phenyl)-5-methyl-benzo[1,2,4]tri...)
Show SMILES Cc1cc(cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc12)-c1c(Cl)cccc1Cl
Show InChI InChI=1S/C26H25Cl2N5O/c1-17-15-18(24-21(27)5-4-6-22(24)28)16-23-25(17)30-26(32-31-23)29-19-7-9-20(10-8-19)34-14-13-33-11-2-3-12-33/h4-10,15-16H,2-3,11-14H2,1H3,(H,29,30,32)
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n/an/a 14n/an/an/an/an/an/a



TargeGen Inc.

Curated by ChEMBL


Assay Description
Inhibition of Src


J Med Chem 51: 1546-59 (2008)


Article DOI: 10.1021/jm7011276
BindingDB Entry DOI: 10.7270/Q2NV9K3X
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Yes


(Homo sapiens (Human))
BDBM50198813
PNG
(7-(2-chlorophenyl)-5-methyl-N-(4-(2-(pyrrolidin-1-...)
Show SMILES Cc1cc(cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc12)-c1ccccc1Cl
Show InChI InChI=1S/C26H26ClN5O/c1-18-16-19(22-6-2-3-7-23(22)27)17-24-25(18)29-26(31-30-24)28-20-8-10-21(11-9-20)33-15-14-32-12-4-5-13-32/h2-3,6-11,16-17H,4-5,12-15H2,1H3,(H,28,29,31)
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n/an/a 22n/an/an/an/an/an/a



TargeGen Inc.

Curated by ChEMBL


Assay Description
Inhibition of YES


J Med Chem 51: 1546-59 (2008)


Article DOI: 10.1021/jm7011276
BindingDB Entry DOI: 10.7270/Q2NV9K3X
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50198813
PNG
(7-(2-chlorophenyl)-5-methyl-N-(4-(2-(pyrrolidin-1-...)
Show SMILES Cc1cc(cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc12)-c1ccccc1Cl
Show InChI InChI=1S/C26H26ClN5O/c1-18-16-19(22-6-2-3-7-23(22)27)17-24-25(18)29-26(31-30-24)28-20-8-10-21(11-9-20)33-15-14-32-12-4-5-13-32/h2-3,6-11,16-17H,4-5,12-15H2,1H3,(H,28,29,31)
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n/an/a 35n/an/an/an/an/an/a



TargeGen Inc.

Curated by ChEMBL


Assay Description
Inhibition of Src


J Med Chem 51: 1546-59 (2008)


Article DOI: 10.1021/jm7011276
BindingDB Entry DOI: 10.7270/Q2NV9K3X
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Yes


(Homo sapiens (Human))
BDBM50198805
PNG
(5-methyl-7-phenyl-N-(4-(2-(pyrrolidin-1-yl)ethoxy)...)
Show SMILES Cc1cc(cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc12)-c1ccccc1
Show InChI InChI=1S/C26H27N5O/c1-19-17-21(20-7-3-2-4-8-20)18-24-25(19)28-26(30-29-24)27-22-9-11-23(12-10-22)32-16-15-31-13-5-6-14-31/h2-4,7-12,17-18H,5-6,13-16H2,1H3,(H,27,28,30)
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n/an/a 110n/an/an/an/an/an/a



TargeGen Inc.

Curated by ChEMBL


Assay Description
Inhibition of YES


J Med Chem 51: 1546-59 (2008)


Article DOI: 10.1021/jm7011276
BindingDB Entry DOI: 10.7270/Q2NV9K3X
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50198782
PNG
(([7-(2,6-dichloro-phenyl)-5-methyl-benzo[1,2,4]tri...)
Show SMILES Cc1cc(cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc12)-c1c(Cl)cccc1Cl
Show InChI InChI=1S/C26H25Cl2N5O/c1-17-15-18(24-21(27)5-4-6-22(24)28)16-23-25(17)30-26(32-31-23)29-19-7-9-20(10-8-19)34-14-13-33-11-2-3-12-33/h4-10,15-16H,2-3,11-14H2,1H3,(H,29,30,32)
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n/an/a 130n/an/an/an/an/an/a



TargeGen Inc.

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2


J Med Chem 51: 1546-59 (2008)


Article DOI: 10.1021/jm7011276
BindingDB Entry DOI: 10.7270/Q2NV9K3X
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50198805
PNG
(5-methyl-7-phenyl-N-(4-(2-(pyrrolidin-1-yl)ethoxy)...)
Show SMILES Cc1cc(cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc12)-c1ccccc1
Show InChI InChI=1S/C26H27N5O/c1-19-17-21(20-7-3-2-4-8-20)18-24-25(19)28-26(30-29-24)27-22-9-11-23(12-10-22)32-16-15-31-13-5-6-14-31/h2-4,7-12,17-18H,5-6,13-16H2,1H3,(H,27,28,30)
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n/an/a 340n/an/an/an/an/an/a



TargeGen Inc.

Curated by ChEMBL


Assay Description
Inhibition of Src


J Med Chem 51: 1546-59 (2008)


Article DOI: 10.1021/jm7011276
BindingDB Entry DOI: 10.7270/Q2NV9K3X
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50198805
PNG
(5-methyl-7-phenyl-N-(4-(2-(pyrrolidin-1-yl)ethoxy)...)
Show SMILES Cc1cc(cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc12)-c1ccccc1
Show InChI InChI=1S/C26H27N5O/c1-19-17-21(20-7-3-2-4-8-20)18-24-25(19)28-26(30-29-24)27-22-9-11-23(12-10-22)32-16-15-31-13-5-6-14-31/h2-4,7-12,17-18H,5-6,13-16H2,1H3,(H,27,28,30)
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n/an/a 530n/an/an/an/an/an/a



TargeGen Inc.

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2


J Med Chem 51: 1546-59 (2008)


Article DOI: 10.1021/jm7011276
BindingDB Entry DOI: 10.7270/Q2NV9K3X
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50221563
PNG
((4-(7-(2-chloro-5-hydroxyphenyl)-5-methylbenzo[e][...)
Show SMILES Cc1cc(cc2nnc(Nc3ccc(cc3)C(=O)N3CCNCC3)nc12)-c1cc(O)ccc1Cl
Show InChI InChI=1S/C25H23ClN6O2/c1-15-12-17(20-14-19(33)6-7-21(20)26)13-22-23(15)29-25(31-30-22)28-18-4-2-16(3-5-18)24(34)32-10-8-27-9-11-32/h2-7,12-14,27,33H,8-11H2,1H3,(H,28,29,31)
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n/an/a 530n/an/an/an/an/an/a



TargeGen Inc.

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2


J Med Chem 51: 1546-59 (2008)


Article DOI: 10.1021/jm7011276
BindingDB Entry DOI: 10.7270/Q2NV9K3X
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50193874
PNG
(7-(2,6-dimethylphenyl)-5-methyl-N-(4-(2-(pyrrolidi...)
Show SMILES Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccc(OCCN4CCCC4)cc3)nnc2c1
Show InChI InChI=1S/C28H31N5O/c1-19-7-6-8-20(2)26(19)22-17-21(3)27-25(18-22)31-32-28(30-27)29-23-9-11-24(12-10-23)34-16-15-33-13-4-5-14-33/h6-12,17-18H,4-5,13-16H2,1-3H3,(H,29,30,32)
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n/an/a 560n/an/an/an/an/an/a



TargeGen Inc.

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2


J Med Chem 51: 1546-59 (2008)


Article DOI: 10.1021/jm7011276
BindingDB Entry DOI: 10.7270/Q2NV9K3X
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50198813
PNG
(7-(2-chlorophenyl)-5-methyl-N-(4-(2-(pyrrolidin-1-...)
Show SMILES Cc1cc(cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc12)-c1ccccc1Cl
Show InChI InChI=1S/C26H26ClN5O/c1-18-16-19(22-6-2-3-7-23(22)27)17-24-25(18)29-26(31-30-24)28-20-8-10-21(11-9-20)33-15-14-32-12-4-5-13-32/h2-3,6-11,16-17H,4-5,12-15H2,1H3,(H,28,29,31)
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n/an/a 1.90E+3n/an/an/an/an/an/a



TargeGen Inc.

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2


J Med Chem 51: 1546-59 (2008)


Article DOI: 10.1021/jm7011276
BindingDB Entry DOI: 10.7270/Q2NV9K3X
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%