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Compile Data Set for Download or QSAR

Found 30 hits with Last Name = 'serry' and Initial = 'am'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM5445
PNG
(CHEMBL554 | GW572016 | LAPATINIB DITOSYLATE | Lapa...)
Show SMILES CS(=O)(=O)CCNCc1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
Show InChI InChI=1S/C29H26ClFN4O4S/c1-40(36,37)12-11-32-16-23-7-10-27(39-23)20-5-8-26-24(14-20)29(34-18-33-26)35-22-6-9-28(25(30)15-22)38-17-19-3-2-4-21(31)13-19/h2-10,13-15,18,32H,11-12,16-17H2,1H3,(H,33,34,35)
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n/an/a 15n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of EGFR (unknown origin)


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128258
BindingDB Entry DOI: 10.7270/Q2930XXQ
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50566726
PNG
(CHEMBL4868909)
Show SMILES COc1cccc(c1)-c1cc(nc(N)c1C#N)-c1c(O)c2ccccc2oc1=O
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n/an/a 20n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of PDGFRbeta (unknown origin)


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128258
BindingDB Entry DOI: 10.7270/Q2930XXQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 1/2/3/4


(Homo sapiens (Human))
BDBM50566726
PNG
(CHEMBL4868909)
Show SMILES COc1cccc(c1)-c1cc(nc(N)c1C#N)-c1c(O)c2ccccc2oc1=O
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n/an/a 21n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of FGFR (unknown origin)


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128258
BindingDB Entry DOI: 10.7270/Q2930XXQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 1/2/3/4


(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 27n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of FGFR (unknown origin)


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128258
BindingDB Entry DOI: 10.7270/Q2930XXQ
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50566726
PNG
(CHEMBL4868909)
Show SMILES COc1cccc(c1)-c1cc(nc(N)c1C#N)-c1c(O)c2ccccc2oc1=O
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n/an/a 33n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of EGFR (unknown origin)


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128258
BindingDB Entry DOI: 10.7270/Q2930XXQ
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM13336
PNG
(4-[4-(4-fluorophenyl)-2-(4-methanesulfinylphenyl)-...)
Show SMILES CS(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccc(F)cc1)-c1ccncc1
Show InChI InChI=1S/C21H16FN3OS/c1-27(26)18-8-4-16(5-9-18)21-24-19(14-2-6-17(22)7-3-14)20(25-21)15-10-12-23-13-11-15/h2-13H,1H3,(H,24,25)
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n/an/a 35n/an/an/an/a7.537



German University in Cairo



Assay Description
Kinase assay using p38alpha MAP.


J Comb Chem 12: 559-65 (2010)


Article DOI: 10.1021/cc1000488
BindingDB Entry DOI: 10.7270/Q2FT8JN3
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM50566726
PNG
(CHEMBL4868909)
Show SMILES COc1cccc(c1)-c1cc(nc(N)c1C#N)-c1c(O)c2ccccc2oc1=O
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n/an/a 42n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of VEGFR2 (unknown origin)


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128258
BindingDB Entry DOI: 10.7270/Q2930XXQ
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(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 55n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of PDGFRbeta (unknown origin)


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128258
BindingDB Entry DOI: 10.7270/Q2930XXQ
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM21
PNG
(CHEMBL24828 | N-(4-bromo-2-fluorophenyl)-6-methoxy...)
Show SMILES COc1cc2c(Nc3ccc(Br)cc3F)ncnc2cc1OCC1CCN(C)CC1
Show InChI InChI=1S/C22H24BrFN4O2/c1-28-7-5-14(6-8-28)12-30-21-11-19-16(10-20(21)29-2)22(26-13-25-19)27-18-4-3-15(23)9-17(18)24/h3-4,9-11,13-14H,5-8,12H2,1-2H3,(H,25,26,27)
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n/an/a 69n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of VEGFR2 (unknown origin)


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128258
BindingDB Entry DOI: 10.7270/Q2930XXQ
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM93403
PNG
(MAP Kinase Inhibitor, 2)
Show SMILES Cc1ccc(o1)-c1cc(nc(N)c1C#N)-c1ccc(Br)cc1
Show InChI InChI=1S/C17H12BrN3O/c1-10-2-7-16(22-10)13-8-15(21-17(20)14(13)9-19)11-3-5-12(18)6-4-11/h2-8H,1H3,(H2,20,21)
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n/an/a 70n/an/an/an/a7.537



German University in Cairo



Assay Description
Kinase assay using p38alpha MAP.


J Comb Chem 12: 559-65 (2010)


Article DOI: 10.1021/cc1000488
BindingDB Entry DOI: 10.7270/Q2FT8JN3
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM93407
PNG
(MAP Kinase Inhibitor, 11)
Show SMILES Clc1ccc(cc1Cl)-c1cc([nH]c(=O)c1C#N)-c1ccc(Br)cc1
Show InChI InChI=1S/C18H9BrCl2N2O/c19-12-4-1-10(2-5-12)17-8-13(14(9-22)18(24)23-17)11-3-6-15(20)16(21)7-11/h1-8H,(H,23,24)
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n/an/a 120n/an/an/an/a7.537



German University in Cairo



Assay Description
Kinase assay using p38alpha MAP.


J Comb Chem 12: 559-65 (2010)


Article DOI: 10.1021/cc1000488
BindingDB Entry DOI: 10.7270/Q2FT8JN3
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 11/12/13/14


(Homo sapiens (Human))
BDBM50501701
PNG
(CHEMBL4092497)
Show SMILES COc1c2ccoc2cc2oc(C)c(-c3cc(-c4ccc(F)cc4)c(C#N)c(=N)[nH]3)c(=O)c12
Show InChI InChI=1S/C25H16FN3O4/c1-12-21(23(30)22-20(33-12)10-19-15(7-8-32-19)24(22)31-2)18-9-16(17(11-27)25(28)29-18)13-3-5-14(26)6-4-13/h3-10H,1-2H3,(H2,28,29)
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n/an/a 190n/an/an/an/an/an/a



Cairo University

Curated by ChEMBL


Assay Description
Inhibition of p38 MAPK (unknown origin) using ATF2 as substrate measured after 15 by ELISA


Bioorg Med Chem 25: 2423-2436 (2017)


Article DOI: 10.1016/j.bmc.2017.02.065
BindingDB Entry DOI: 10.7270/Q29026TD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 11/12/13/14


(Homo sapiens (Human))
BDBM50501699
PNG
(CHEMBL4105358)
Show SMILES COc1c2ccoc2cc2oc(C)c(-c3cc(-c4ccc(F)cc4)c(C#N)c(=O)[nH]3)c(=O)c12
Show InChI InChI=1S/C25H15FN2O5/c1-12-21(23(29)22-20(33-12)10-19-15(7-8-32-19)24(22)31-2)18-9-16(17(11-27)25(30)28-18)13-3-5-14(26)6-4-13/h3-10H,1-2H3,(H,28,30)
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n/an/a 230n/an/an/an/an/an/a



Cairo University

Curated by ChEMBL


Assay Description
Inhibition of p38 MAPK (unknown origin) using ATF2 as substrate measured after 15 by ELISA


Bioorg Med Chem 25: 2423-2436 (2017)


Article DOI: 10.1016/j.bmc.2017.02.065
BindingDB Entry DOI: 10.7270/Q29026TD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 11/12/13/14


(Homo sapiens (Human))
BDBM50501707
PNG
(CHEMBL4060860)
Show SMILES COc1ccc(cc1OC)-c1cc([nH]c(=N)c1C#N)-c1c(C)oc2c(OC)c3occc3c(OC)c2c1=O
Show InChI InChI=1S/C28H23N3O7/c1-13-21(23(32)22-24(35-4)15-8-9-37-25(15)27(36-5)26(22)38-13)18-11-16(17(12-29)28(30)31-18)14-6-7-19(33-2)20(10-14)34-3/h6-11H,1-5H3,(H2,30,31)
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n/an/a 310n/an/an/an/an/an/a



Cairo University

Curated by ChEMBL


Assay Description
Inhibition of p38 MAPK (unknown origin) using ATF2 as substrate measured after 15 by ELISA


Bioorg Med Chem 25: 2423-2436 (2017)


Article DOI: 10.1016/j.bmc.2017.02.065
BindingDB Entry DOI: 10.7270/Q29026TD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 11/12/13/14


(Homo sapiens (Human))
BDBM50501705
PNG
(CHEMBL4090844)
Show SMILES COc1c2ccoc2c(OC)c2oc(C)c(-c3cc([nH]c(=S)n3)-c3ccc(F)cc3)c(=O)c12
Show InChI InChI=1S/C24H17FN2O5S/c1-11-17(16-10-15(26-24(33)27-16)12-4-6-13(25)7-5-12)19(28)18-20(29-2)14-8-9-31-21(14)23(30-3)22(18)32-11/h4-10H,1-3H3,(H,26,27,33)
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n/an/a 380n/an/an/an/an/an/a



Cairo University

Curated by ChEMBL


Assay Description
Inhibition of p38 MAPK (unknown origin) using ATF2 as substrate measured after 15 by ELISA


Bioorg Med Chem 25: 2423-2436 (2017)


Article DOI: 10.1016/j.bmc.2017.02.065
BindingDB Entry DOI: 10.7270/Q29026TD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 11/12/13/14


(Homo sapiens (Human))
BDBM50045333
PNG
(CHEBI:90705 | SB-203580)
Show SMILES C[S+]([O-])c1ccc(cc1)-c1nc(c([nH]1)-c1ccncc1)-c1ccc(F)cc1
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n/an/a 500n/an/an/an/an/an/a



Cairo University

Curated by ChEMBL


Assay Description
Inhibition of p38 MAPK (unknown origin) using ATF2 as substrate measured after 15 by ELISA


Bioorg Med Chem 25: 2423-2436 (2017)


Article DOI: 10.1016/j.bmc.2017.02.065
BindingDB Entry DOI: 10.7270/Q29026TD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 11/12/13/14


(Homo sapiens (Human))
BDBM50501700
PNG
(CHEMBL4083494)
Show SMILES COc1c2ccoc2c(OC)c2oc(C)c(-c3cc(-c4ccc(F)cc4)c(C#N)c(=N)[nH]3)c(=O)c12
Show InChI InChI=1S/C26H18FN3O5/c1-12-19(18-10-16(17(11-28)26(29)30-18)13-4-6-14(27)7-5-13)21(31)20-22(32-2)15-8-9-34-23(15)25(33-3)24(20)35-12/h4-10H,1-3H3,(H2,29,30)
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n/an/a 630n/an/an/an/an/an/a



Cairo University

Curated by ChEMBL


Assay Description
Inhibition of p38 MAPK (unknown origin) using ATF2 as substrate measured after 15 by ELISA


Bioorg Med Chem 25: 2423-2436 (2017)


Article DOI: 10.1016/j.bmc.2017.02.065
BindingDB Entry DOI: 10.7270/Q29026TD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 11/12/13/14


(Homo sapiens (Human))
BDBM50501702
PNG
(CHEMBL4101195)
Show SMILES COc1ccc(cc1OC)C1CC(=NN1C(C)=O)c1c(C)oc2c(OC)c3occc3c(OC)c2c1=O |c:13|
Show InChI InChI=1S/C27H26N2O8/c1-13-21(23(31)22-24(34-5)16-9-10-36-25(16)27(35-6)26(22)37-13)17-12-18(29(28-17)14(2)30)15-7-8-19(32-3)20(11-15)33-4/h7-11,18H,12H2,1-6H3
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n/an/a 670n/an/an/an/an/an/a



Cairo University

Curated by ChEMBL


Assay Description
Inhibition of p38 MAPK (unknown origin) using ATF2 as substrate measured after 15 by ELISA


Bioorg Med Chem 25: 2423-2436 (2017)


Article DOI: 10.1016/j.bmc.2017.02.065
BindingDB Entry DOI: 10.7270/Q29026TD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 11/12/13/14


(Homo sapiens (Human))
BDBM50501708
PNG
(CHEMBL4071708)
Show SMILES COc1ccc(cc1OC)-c1cc([nH]c(=N)c1C#N)-c1c(C)oc2cc3occc3c(OC)c2c1=O
Show InChI InChI=1S/C27H21N3O6/c1-13-23(25(31)24-22(36-13)11-20-15(7-8-35-20)26(24)34-4)18-10-16(17(12-28)27(29)30-18)14-5-6-19(32-2)21(9-14)33-3/h5-11H,1-4H3,(H2,29,30)
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n/an/a 720n/an/an/an/an/an/a



Cairo University

Curated by ChEMBL


Assay Description
Inhibition of p38 MAPK (unknown origin) using ATF2 as substrate measured after 15 by ELISA


Bioorg Med Chem 25: 2423-2436 (2017)


Article DOI: 10.1016/j.bmc.2017.02.065
BindingDB Entry DOI: 10.7270/Q29026TD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM93405
PNG
(MAP Kinase Inhibitor, 7)
Show SMILES Nc1nc(cc(-c2ccc(Br)cc2)c1C#N)-c1ccc(Br)cc1
Show InChI InChI=1S/C18H11Br2N3/c19-13-5-1-11(2-6-13)15-9-17(23-18(22)16(15)10-21)12-3-7-14(20)8-4-12/h1-9H,(H2,22,23)
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n/an/a 760n/an/an/an/a7.537



German University in Cairo



Assay Description
Kinase assay using p38alpha MAP.


J Comb Chem 12: 559-65 (2010)


Article DOI: 10.1021/cc1000488
BindingDB Entry DOI: 10.7270/Q2FT8JN3
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 11/12/13/14


(Homo sapiens (Human))
BDBM50501709
PNG
(CHEMBL4081275)
Show SMILES COc1c2ccoc2c(OC)c2oc(C)c(C3=CC(NO3)c3ccc(F)cc3)c(=O)c12 |t:17|
Show InChI InChI=1S/C23H18FNO6/c1-11-17(16-10-15(25-31-16)12-4-6-13(24)7-5-12)19(26)18-20(27-2)14-8-9-29-21(14)23(28-3)22(18)30-11/h4-10,15,25H,1-3H3
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n/an/a 860n/an/an/an/an/an/a



Cairo University

Curated by ChEMBL


Assay Description
Inhibition of p38 MAPK (unknown origin) using ATF2 as substrate measured after 15 by ELISA


Bioorg Med Chem 25: 2423-2436 (2017)


Article DOI: 10.1016/j.bmc.2017.02.065
BindingDB Entry DOI: 10.7270/Q29026TD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 11/12/13/14


(Homo sapiens (Human))
BDBM50501704
PNG
(CHEMBL4105528)
Show SMILES COc1ccc(cc1OC)C1NOC(=C1)c1c(C)oc2c(OC)c3occc3c(OC)c2c1=O |c:14|
Show InChI InChI=1S/C25H23NO8/c1-12-19(18-11-15(26-34-18)13-6-7-16(28-2)17(10-13)29-3)21(27)20-22(30-4)14-8-9-32-23(14)25(31-5)24(20)33-12/h6-11,15,26H,1-5H3
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n/an/a 1.09E+3n/an/an/an/an/an/a



Cairo University

Curated by ChEMBL


Assay Description
Inhibition of p38 MAPK (unknown origin) using ATF2 as substrate measured after 15 by ELISA


Bioorg Med Chem 25: 2423-2436 (2017)


Article DOI: 10.1016/j.bmc.2017.02.065
BindingDB Entry DOI: 10.7270/Q29026TD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 11/12/13/14


(Homo sapiens (Human))
BDBM50501703
PNG
(CHEMBL4065833)
Show SMILES COc1c2occc2c(OC)c2c1oc(C)c(C1=NN(C(C1)c1ccc(F)cc1)c1ccccc1)c2=O |t:19|
Show InChI InChI=1S/C29H23FN2O5/c1-16-23(25(33)24-26(34-2)20-13-14-36-27(20)29(35-3)28(24)37-16)21-15-22(17-9-11-18(30)12-10-17)32(31-21)19-7-5-4-6-8-19/h4-14,22H,15H2,1-3H3
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n/an/a 1.09E+3n/an/an/an/an/an/a



Cairo University

Curated by ChEMBL


Assay Description
Inhibition of p38 MAPK (unknown origin) using ATF2 as substrate measured after 15 by ELISA


Bioorg Med Chem 25: 2423-2436 (2017)


Article DOI: 10.1016/j.bmc.2017.02.065
BindingDB Entry DOI: 10.7270/Q29026TD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM93406
PNG
(MAP Kinase Inhibitor, 8)
Show SMILES COc1cc(cc(OC)c1OC)-c1cc([nH]c(=O)c1C#N)-c1ccc(Br)cc1
Show InChI InChI=1S/C21H17BrN2O4/c1-26-18-8-13(9-19(27-2)20(18)28-3)15-10-17(24-21(25)16(15)11-23)12-4-6-14(22)7-5-12/h4-10H,1-3H3,(H,24,25)
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n/an/a 1.22E+3n/an/an/an/a7.537



German University in Cairo



Assay Description
Kinase assay using p38alpha MAP.


J Comb Chem 12: 559-65 (2010)


Article DOI: 10.1021/cc1000488
BindingDB Entry DOI: 10.7270/Q2FT8JN3
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 11/12/13/14


(Homo sapiens (Human))
BDBM50501706
PNG
(CHEMBL4069040)
Show SMILES COc1ccc(cc1OC)-c1cc(nc(=S)[nH]1)-c1c(C)oc2c(OC)c3occc3c(OC)c2c1=O
Show InChI InChI=1S/C26H22N2O7S/c1-12-19(16-11-15(27-26(36)28-16)13-6-7-17(30-2)18(10-13)31-3)21(29)20-22(32-4)14-8-9-34-23(14)25(33-5)24(20)35-12/h6-11H,1-5H3,(H,27,28,36)
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n/an/a 1.39E+3n/an/an/an/an/an/a



Cairo University

Curated by ChEMBL


Assay Description
Inhibition of p38 MAPK (unknown origin) using ATF2 as substrate measured after 15 by ELISA


Bioorg Med Chem 25: 2423-2436 (2017)


Article DOI: 10.1016/j.bmc.2017.02.065
BindingDB Entry DOI: 10.7270/Q29026TD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM93401
PNG
(MAP Kinase Inhibitor, 1)
Show SMILES COc1cc(cc(OC)c1OC)-c1cc(nc(N)c1C#N)-c1ccc(Br)cc1
Show InChI InChI=1S/C21H18BrN3O3/c1-26-18-8-13(9-19(27-2)20(18)28-3)15-10-17(25-21(24)16(15)11-23)12-4-6-14(22)7-5-12/h4-10H,1-3H3,(H2,24,25)
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n/an/a 2.00E+3n/an/an/an/a7.537



German University in Cairo



Assay Description
Kinase assay using p38alpha MAP.


J Comb Chem 12: 559-65 (2010)


Article DOI: 10.1021/cc1000488
BindingDB Entry DOI: 10.7270/Q2FT8JN3
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM93409
PNG
(MAP Kinase Inhibitor, 6)
Show SMILES Nc1nc(cc(-c2c[nH]c3ccccc23)c1C#N)-c1ccc(Br)cc1
Show InChI InChI=1S/C20H13BrN4/c21-13-7-5-12(6-8-13)19-9-15(16(10-22)20(23)25-19)17-11-24-18-4-2-1-3-14(17)18/h1-9,11,24H,(H2,23,25)
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n/an/a 2.65E+3n/an/an/an/a7.537



German University in Cairo



Assay Description
Kinase assay using p38alpha MAP.


J Comb Chem 12: 559-65 (2010)


Article DOI: 10.1021/cc1000488
BindingDB Entry DOI: 10.7270/Q2FT8JN3
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM93404
PNG
(MAP Kinase Inhibitor, 4)
Show SMILES Nc1nc(cc(-c2ccc(Cl)c(Cl)c2)c1C#N)-c1ccc(Br)cc1
Show InChI InChI=1S/C18H10BrCl2N3/c19-12-4-1-10(2-5-12)17-8-13(14(9-22)18(23)24-17)11-3-6-15(20)16(21)7-11/h1-8H,(H2,23,24)
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n/an/a 3.68E+3n/an/an/an/a7.537



German University in Cairo



Assay Description
Kinase assay using p38alpha MAP.


J Comb Chem 12: 559-65 (2010)


Article DOI: 10.1021/cc1000488
BindingDB Entry DOI: 10.7270/Q2FT8JN3
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM93402
PNG
(MAP Kinase Inhibitor, 3)
Show SMILES Nc1nc(cc(-c2cccnc2)c1C#N)-c1ccc(Br)cc1
Show InChI InChI=1S/C17H11BrN4/c18-13-5-3-11(4-6-13)16-8-14(12-2-1-7-21-10-12)15(9-19)17(20)22-16/h1-8,10H,(H2,20,22)
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n/an/a 3.70E+3n/an/an/an/a7.537



German University in Cairo



Assay Description
Kinase assay using p38alpha MAP.


J Comb Chem 12: 559-65 (2010)


Article DOI: 10.1021/cc1000488
BindingDB Entry DOI: 10.7270/Q2FT8JN3
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM93408
PNG
(MAP Kinase Inhibitor, 14)
Show SMILES Brc1ccc(cc1)-c1cc(-c2ccc(Br)cc2)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C18H10Br2N2O/c19-13-5-1-11(2-6-13)15-9-17(22-18(23)16(15)10-21)12-3-7-14(20)8-4-12/h1-9H,(H,22,23)
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n/an/a 4.40E+3n/an/an/an/a7.537



German University in Cairo



Assay Description
Kinase assay using p38alpha MAP.


J Comb Chem 12: 559-65 (2010)


Article DOI: 10.1021/cc1000488
BindingDB Entry DOI: 10.7270/Q2FT8JN3
More data for this
Ligand-Target Pair