Found 40 hits of Enzyme Inhibition Constant Data Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Mitogen-activated protein kinase kinase kinase 8
(Homo sapiens (Human)) | BDBM50173838
(4-(4-benzylphenylamino)-6-(2-morpholinoethylamino)...)Show SMILES N#Cc1cnc2cnc(NCCN3CCOCC3)cc2c1Nc1ccc(Cc2ccccc2)cc1 Show InChI InChI=1S/C28H28N6O/c29-18-23-19-31-26-20-32-27(30-10-11-34-12-14-35-15-13-34)17-25(26)28(23)33-24-8-6-22(7-9-24)16-21-4-2-1-3-5-21/h1-9,17,19-20H,10-16H2,(H,30,32)(H,31,33) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against human Tpl2 kinase via quantification of MEK phosphorylation |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase 8
(Homo sapiens (Human)) | BDBM50173833
(6-(2-morpholinoethylamino)-4-(4-(phenylthio)phenyl...)Show SMILES N#Cc1cnc2cnc(NCCN3CCOCC3)cc2c1Nc1ccc(Sc2ccccc2)cc1 Show InChI InChI=1S/C27H26N6OS/c28-17-20-18-30-25-19-31-26(29-10-11-33-12-14-34-15-13-33)16-24(25)27(20)32-21-6-8-23(9-7-21)35-22-4-2-1-3-5-22/h1-9,16,18-19H,10-15H2,(H,29,31)(H,30,32) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against human Tpl2 kinase via quantification of MEK phosphorylation |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase 8
(Homo sapiens (Human)) | BDBM50173834
((R)-4-(3-chloro-4-fluorophenylamino)-6-(1-phenylet...)Show SMILES C[C@@H](Nc1cc2c(Nc3ccc(F)c(Cl)c3)c(cnc2cn1)C#N)c1ccccc1 |r| Show InChI InChI=1S/C23H17ClFN5/c1-14(15-5-3-2-4-6-15)29-22-10-18-21(13-28-22)27-12-16(11-26)23(18)30-17-7-8-20(25)19(24)9-17/h2-10,12-14H,1H3,(H,27,30)(H,28,29)/t14-/m1/s1 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against human Tpl2 kinase via quantification of MEK phosphorylation |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase 8
(Homo sapiens (Human)) | BDBM50173832
(4-(3-chloro-4-fluorophenylamino)-6-(pyridin-3-ylme...)Show SMILES Fc1ccc(Nc2c(cnc3cnc(NCc4cccnc4)cc23)C#N)cc1Cl Show InChI InChI=1S/C21H14ClFN6/c22-17-6-15(3-4-18(17)23)29-21-14(8-24)11-26-19-12-28-20(7-16(19)21)27-10-13-2-1-5-25-9-13/h1-7,9,11-12H,10H2,(H,26,29)(H,27,28) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 50 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against human Tpl2 kinase via quantification of MEK phosphorylation |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase 8
(Homo sapiens (Human)) | BDBM50173850
(6-(benzylamino)-4-(3-chloro-4-fluorophenylamino)-1...)Show SMILES Fc1ccc(Nc2c(cnc3cnc(NCc4ccccc4)cc23)C#N)cc1Cl Show InChI InChI=1S/C22H15ClFN5/c23-18-8-16(6-7-19(18)24)29-22-15(10-25)12-26-20-13-28-21(9-17(20)22)27-11-14-4-2-1-3-5-14/h1-9,12-13H,11H2,(H,26,29)(H,27,28) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 73 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against human Tpl2 kinase via quantification of MEK phosphorylation |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase 8
(Homo sapiens (Human)) | BDBM50173837
(6-(2-morpholinoethylamino)-4-(4-phenoxyphenylamino...)Show SMILES N#Cc1cnc2cnc(NCCN3CCOCC3)cc2c1Nc1ccc(Oc2ccccc2)cc1 Show InChI InChI=1S/C27H26N6O2/c28-17-20-18-30-25-19-31-26(29-10-11-33-12-14-34-15-13-33)16-24(25)27(20)32-21-6-8-23(9-7-21)35-22-4-2-1-3-5-22/h1-9,16,18-19H,10-15H2,(H,29,31)(H,30,32) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 380 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against human Tpl2 kinase via quantification of MEK phosphorylation |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase 8
(Homo sapiens (Human)) | BDBM50173851
((R)-4-(3-chloro-4-fluorophenylamino)-6-(1-phenylpr...)Show SMILES CC[C@@H](Nc1cc2c(Nc3ccc(F)c(Cl)c3)c(cnc2cn1)C#N)c1ccccc1 Show InChI InChI=1S/C24H19ClFN5/c1-2-21(15-6-4-3-5-7-15)31-23-11-18-22(14-29-23)28-13-16(12-27)24(18)30-17-8-9-20(26)19(25)10-17/h3-11,13-14,21H,2H2,1H3,(H,28,30)(H,29,31)/t21-/m1/s1 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 414 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against human Tpl2 kinase via quantification of MEK phosphorylation |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Dual specificity mitogen-activated protein kinase kinase 1
(Homo sapiens (Human)) | BDBM50173838
(4-(4-benzylphenylamino)-6-(2-morpholinoethylamino)...)Show SMILES N#Cc1cnc2cnc(NCCN3CCOCC3)cc2c1Nc1ccc(Cc2ccccc2)cc1 Show InChI InChI=1S/C28H28N6O/c29-18-23-19-31-26-20-32-27(30-10-11-34-12-14-35-15-13-34)17-25(26)28(23)33-24-8-6-22(7-9-24)16-21-4-2-1-3-5-21/h1-9,17,19-20H,10-16H2,(H,30,32)(H,31,33) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 630 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against MEK |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Dual specificity mitogen-activated protein kinase kinase 1
(Homo sapiens (Human)) | BDBM50173837
(6-(2-morpholinoethylamino)-4-(4-phenoxyphenylamino...)Show SMILES N#Cc1cnc2cnc(NCCN3CCOCC3)cc2c1Nc1ccc(Oc2ccccc2)cc1 Show InChI InChI=1S/C27H26N6O2/c28-17-20-18-30-25-19-31-26(29-10-11-33-12-14-34-15-13-33)16-24(25)27(20)32-21-6-8-23(9-7-21)35-22-4-2-1-3-5-22/h1-9,16,18-19H,10-15H2,(H,29,31)(H,30,32) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 800 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against MEK |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Dual specificity mitogen-activated protein kinase kinase 1
(Homo sapiens (Human)) | BDBM50173833
(6-(2-morpholinoethylamino)-4-(4-(phenylthio)phenyl...)Show SMILES N#Cc1cnc2cnc(NCCN3CCOCC3)cc2c1Nc1ccc(Sc2ccccc2)cc1 Show InChI InChI=1S/C27H26N6OS/c28-17-20-18-30-25-19-31-26(29-10-11-33-12-14-34-15-13-33)16-24(25)27(20)32-21-6-8-23(9-7-21)35-22-4-2-1-3-5-22/h1-9,16,18-19H,10-15H2,(H,29,31)(H,30,32) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 960 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against MEK |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase 8
(Homo sapiens (Human)) | BDBM29896
(1,7-naphthyridine-3-carbonitrile, 1 | CHEMBL197538)Show SMILES Fc1ccc(Nc2c(cnc3cnc(NCCN4CCOCC4)cc23)C#N)cc1Cl Show InChI InChI=1S/C21H20ClFN6O/c22-17-9-15(1-2-18(17)23)28-21-14(11-24)12-26-19-13-27-20(10-16(19)21)25-3-4-29-5-7-30-8-6-29/h1-2,9-10,12-13H,3-8H2,(H,25,27)(H,26,28) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against human Tpl2 kinase via quantification of MEK phosphorylation |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase 8
(Homo sapiens (Human)) | BDBM50173844
(4-(3-chloro-4-fluorophenylamino)-6-(2-morpholino-1...)Show SMILES Fc1ccc(Nc2c(cnc3cnc(NC(CN4CCOCC4)c4ccccc4)cc23)C#N)cc1Cl Show InChI InChI=1S/C27H24ClFN6O/c28-22-12-20(6-7-23(22)29)33-27-19(14-30)15-31-24-16-32-26(13-21(24)27)34-25(18-4-2-1-3-5-18)17-35-8-10-36-11-9-35/h1-7,12-13,15-16,25H,8-11,17H2,(H,31,33)(H,32,34) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against human Tpl2 kinase via quantification of MEK phosphorylation |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Proto-oncogene tyrosine-protein kinase Src
(Homo sapiens (Human)) | BDBM50173833
(6-(2-morpholinoethylamino)-4-(4-(phenylthio)phenyl...)Show SMILES N#Cc1cnc2cnc(NCCN3CCOCC3)cc2c1Nc1ccc(Sc2ccccc2)cc1 Show InChI InChI=1S/C27H26N6OS/c28-17-20-18-30-25-19-31-26(29-10-11-33-12-14-34-15-13-33)16-24(25)27(20)32-21-6-8-23(9-7-21)35-22-4-2-1-3-5-22/h1-9,16,18-19H,10-15H2,(H,29,31)(H,30,32) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against Src |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase 8
(Homo sapiens (Human)) | BDBM50173845
(4-(3-chloro-4-fluorophenylamino)-6-(3-morpholinopr...)Show SMILES Fc1ccc(Nc2c(cnc3cnc(NCCCN4CCOCC4)cc23)C#N)cc1Cl Show InChI InChI=1S/C22H22ClFN6O/c23-18-10-16(2-3-19(18)24)29-22-15(12-25)13-27-20-14-28-21(11-17(20)22)26-4-1-5-30-6-8-31-9-7-30/h2-3,10-11,13-14H,1,4-9H2,(H,26,28)(H,27,29) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against human Tpl2 kinase via quantification of MEK phosphorylation |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase 8
(Homo sapiens (Human)) | BDBM50173829
(4-(3-chloro-4-fluorophenylamino)-6-(3-(pyrrolidin-...)Show SMILES Fc1ccc(Nc2c(cnc3cnc(NCCCN4CCCC4)cc23)C#N)cc1Cl Show InChI InChI=1S/C22H22ClFN6/c23-18-10-16(4-5-19(18)24)29-22-15(12-25)13-27-20-14-28-21(11-17(20)22)26-6-3-9-30-7-1-2-8-30/h4-5,10-11,13-14H,1-3,6-9H2,(H,26,28)(H,27,29) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.57E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against human Tpl2 kinase via quantification of MEK phosphorylation |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Proto-oncogene tyrosine-protein kinase Src
(Homo sapiens (Human)) | BDBM50173838
(4-(4-benzylphenylamino)-6-(2-morpholinoethylamino)...)Show SMILES N#Cc1cnc2cnc(NCCN3CCOCC3)cc2c1Nc1ccc(Cc2ccccc2)cc1 Show InChI InChI=1S/C28H28N6O/c29-18-23-19-31-26-20-32-27(30-10-11-34-12-14-35-15-13-34)17-25(26)28(23)33-24-8-6-22(7-9-24)16-21-4-2-1-3-5-21/h1-9,17,19-20H,10-16H2,(H,30,32)(H,31,33) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against Src |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase 8
(Homo sapiens (Human)) | BDBM50173843
(4-(3,5-dichlorophenylamino)-6-(2-morpholinoethylam...)Show SMILES Clc1cc(Cl)cc(Nc2c(cnc3cnc(NCCN4CCOCC4)cc23)C#N)c1 Show InChI InChI=1S/C21H20Cl2N6O/c22-15-7-16(23)9-17(8-15)28-21-14(11-24)12-26-19-13-27-20(10-18(19)21)25-1-2-29-3-5-30-6-4-29/h7-10,12-13H,1-6H2,(H,25,27)(H,26,28) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against human Tpl2 kinase via quantification of MEK phosphorylation |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase 8
(Homo sapiens (Human)) | BDBM50173846
(4-(4-benzoylphenylamino)-6-(2-morpholinoethylamino...)Show SMILES O=C(c1ccccc1)c1ccc(Nc2c(cnc3cnc(NCCN4CCOCC4)cc23)C#N)cc1 Show InChI InChI=1S/C28H26N6O2/c29-17-22-18-31-25-19-32-26(30-10-11-34-12-14-36-15-13-34)16-24(25)27(22)33-23-8-6-21(7-9-23)28(35)20-4-2-1-3-5-20/h1-9,16,18-19H,10-15H2,(H,30,32)(H,31,33) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against human Tpl2 kinase via quantification of MEK phosphorylation |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase 8
(Homo sapiens (Human)) | BDBM50173841
(4-(4-chloro-2-fluorophenylamino)-6-(2-morpholinoet...)Show SMILES Fc1cc(Cl)ccc1Nc1c(cnc2cnc(NCCN3CCOCC3)cc12)C#N Show InChI InChI=1S/C21H20ClFN6O/c22-15-1-2-18(17(23)9-15)28-21-14(11-24)12-26-19-13-27-20(10-16(19)21)25-3-4-29-5-7-30-8-6-29/h1-2,9-10,12-13H,3-8H2,(H,25,27)(H,26,28) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against human Tpl2 kinase via quantification of MEK phosphorylation |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase 8
(Homo sapiens (Human)) | BDBM50173836
(4-(3,4-dichlorophenylamino)-6-(2-morpholinoethylam...)Show SMILES Clc1ccc(Nc2c(cnc3cnc(NCCN4CCOCC4)cc23)C#N)cc1Cl Show InChI InChI=1S/C21H20Cl2N6O/c22-17-2-1-15(9-18(17)23)28-21-14(11-24)12-26-19-13-27-20(10-16(19)21)25-3-4-29-5-7-30-8-6-29/h1-2,9-10,12-13H,3-8H2,(H,25,27)(H,26,28) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against human Tpl2 kinase via quantification of MEK phosphorylation |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Dual specificity mitogen-activated protein kinase kinase 1
(Homo sapiens (Human)) | BDBM29896
(1,7-naphthyridine-3-carbonitrile, 1 | CHEMBL197538)Show SMILES Fc1ccc(Nc2c(cnc3cnc(NCCN4CCOCC4)cc23)C#N)cc1Cl Show InChI InChI=1S/C21H20ClFN6O/c22-17-9-15(1-2-18(17)23)28-21-14(11-24)12-26-19-13-27-20(10-16(19)21)25-3-4-29-5-7-30-8-6-29/h1-2,9-10,12-13H,3-8H2,(H,25,27)(H,26,28) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against MEK |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase 8
(Homo sapiens (Human)) | BDBM50173831
(4-(3-chloro-4-fluorophenylamino)-6-(3-(4-methylpip...)Show SMILES CN1CCN(CCCNc2cc3c(Nc4ccc(F)c(Cl)c4)c(cnc3cn2)C#N)CC1 Show InChI InChI=1S/C23H25ClFN7/c1-31-7-9-32(10-8-31)6-2-5-27-22-12-18-21(15-29-22)28-14-16(13-26)23(18)30-17-3-4-20(25)19(24)11-17/h3-4,11-12,14-15H,2,5-10H2,1H3,(H,27,29)(H,28,30) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.10E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against human Tpl2 kinase via quantification of MEK phosphorylation |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase 8
(Homo sapiens (Human)) | BDBM50173830
((S)-4-(3-chloro-4-fluorophenylamino)-6-(1-phenylet...)Show SMILES C[C@H](Nc1cc2c(Nc3ccc(F)c(Cl)c3)c(cnc2cn1)C#N)c1ccccc1 |r| Show InChI InChI=1S/C23H17ClFN5/c1-14(15-5-3-2-4-6-15)29-22-10-18-21(13-28-22)27-12-16(11-26)23(18)30-17-7-8-20(25)19(24)9-17/h2-10,12-14H,1H3,(H,27,30)(H,28,29)/t14-/m0/s1 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.70E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against human Tpl2 kinase via quantification of MEK phosphorylation |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Proto-oncogene tyrosine-protein kinase Src
(Homo sapiens (Human)) | BDBM29896
(1,7-naphthyridine-3-carbonitrile, 1 | CHEMBL197538)Show SMILES Fc1ccc(Nc2c(cnc3cnc(NCCN4CCOCC4)cc23)C#N)cc1Cl Show InChI InChI=1S/C21H20ClFN6O/c22-17-9-15(1-2-18(17)23)28-21-14(11-24)12-26-19-13-27-20(10-16(19)21)25-3-4-29-5-7-30-8-6-29/h1-2,9-10,12-13H,3-8H2,(H,25,27)(H,26,28) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against Src |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase 8
(Homo sapiens (Human)) | BDBM50173847
((S)-4-(3-chloro-4-fluorophenylamino)-6-(1-phenylpr...)Show SMILES CC[C@H](Nc1cc2c(Nc3ccc(F)c(Cl)c3)c(cnc2cn1)C#N)c1ccccc1 Show InChI InChI=1S/C24H19ClFN5/c1-2-21(15-6-4-3-5-7-15)31-23-11-18-22(14-29-23)28-13-16(12-27)24(18)30-17-8-9-20(26)19(25)10-17/h3-11,13-14,21H,2H2,1H3,(H,28,30)(H,29,31)/t21-/m0/s1 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against human Tpl2 kinase via quantification of MEK phosphorylation |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase 8
(Homo sapiens (Human)) | BDBM50173839
(6-(benzyl(methyl)amino)-4-(3-chloro-4-fluorophenyl...)Show SMILES CN(Cc1ccccc1)c1cc2c(Nc3ccc(F)c(Cl)c3)c(cnc2cn1)C#N Show InChI InChI=1S/C23H17ClFN5/c1-30(14-15-5-3-2-4-6-15)22-10-18-21(13-28-22)27-12-16(11-26)23(18)29-17-7-8-20(25)19(24)9-17/h2-10,12-13H,14H2,1H3,(H,27,29) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against human Tpl2 kinase via quantification of MEK phosphorylation |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase 8
(Homo sapiens (Human)) | BDBM50173849
(6-(2-morpholinoethylamino)-4-(4-(phenylsulfonyl)ph...)Show SMILES O=S(=O)(c1ccccc1)c1ccc(Nc2c(cnc3cnc(NCCN4CCOCC4)cc23)C#N)cc1 Show InChI InChI=1S/C27H26N6O3S/c28-17-20-18-30-25-19-31-26(29-10-11-33-12-14-36-15-13-33)16-24(25)27(20)32-21-6-8-23(9-7-21)37(34,35)22-4-2-1-3-5-22/h1-9,16,18-19H,10-15H2,(H,29,31)(H,30,32) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against human Tpl2 kinase via quantification of MEK phosphorylation |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase 8
(Homo sapiens (Human)) | BDBM50173835
(4-(3-bromo-2-methylphenylamino)-6-(2-morpholinoeth...)Show SMILES Cc1c(Br)cccc1Nc1c(cnc2cnc(NCCN3CCOCC3)cc12)C#N Show InChI InChI=1S/C22H23BrN6O/c1-15-18(23)3-2-4-19(15)28-22-16(12-24)13-26-20-14-27-21(11-17(20)22)25-5-6-29-7-9-30-10-8-29/h2-4,11,13-14H,5-10H2,1H3,(H,25,27)(H,26,28) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against human Tpl2 kinase via quantification of MEK phosphorylation |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Dual specificity mitogen-activated protein kinase kinase 1
(Homo sapiens (Human)) | BDBM50173832
(4-(3-chloro-4-fluorophenylamino)-6-(pyridin-3-ylme...)Show SMILES Fc1ccc(Nc2c(cnc3cnc(NCc4cccnc4)cc23)C#N)cc1Cl Show InChI InChI=1S/C21H14ClFN6/c22-17-6-15(3-4-18(17)23)29-21-14(8-24)11-26-19-12-28-20(7-16(19)21)27-10-13-2-1-5-25-9-13/h1-7,9,11-12H,10H2,(H,26,29)(H,27,28) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against MEK |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase 8
(Homo sapiens (Human)) | BDBM50173842
(6-(2-morpholinoethylamino)-4-(4-(trifluoromethyl)p...)Show SMILES FC(F)(F)c1ccc(Nc2c(cnc3cnc(NCCN4CCOCC4)cc23)C#N)cc1 Show InChI InChI=1S/C22H21F3N6O/c23-22(24,25)16-1-3-17(4-2-16)30-21-15(12-26)13-28-19-14-29-20(11-18(19)21)27-5-6-31-7-9-32-10-8-31/h1-4,11,13-14H,5-10H2,(H,27,29)(H,28,30) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against human Tpl2 kinase via quantification of MEK phosphorylation |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase 8
(Homo sapiens (Human)) | BDBM50173848
(4-(4-chlorophenylamino)-6-(2-morpholinoethylamino)...)Show SMILES Clc1ccc(Nc2c(cnc3cnc(NCCN4CCOCC4)cc23)C#N)cc1 Show InChI InChI=1S/C21H21ClN6O/c22-16-1-3-17(4-2-16)27-21-15(12-23)13-25-19-14-26-20(11-18(19)21)24-5-6-28-7-9-29-10-8-28/h1-4,11,13-14H,5-10H2,(H,24,26)(H,25,27) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against human Tpl2 kinase via quantification of MEK phosphorylation |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase 8
(Homo sapiens (Human)) | BDBM50173840
(4-(3-chloro-4-fluorobenzylamino)-6-(2-morpholinoet...)Show SMILES Fc1ccc(CNc2c(cnc3cnc(NCCN4CCOCC4)cc23)C#N)cc1Cl Show InChI InChI=1S/C22H22ClFN6O/c23-18-9-15(1-2-19(18)24)12-29-22-16(11-25)13-27-20-14-28-21(10-17(20)22)26-3-4-30-5-7-31-8-6-30/h1-2,9-10,13-14H,3-8,12H2,(H,26,28)(H,27,29) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against human Tpl2 kinase via quantification of MEK phosphorylation |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase kinase kinase 8
(Homo sapiens (Human)) | BDBM50173852
(4-(3-chloro-4-fluorophenylamino)-6-(cyclopentylami...)Show SMILES Fc1ccc(Nc2c(cnc3cnc(NC4CCCC4)cc23)C#N)cc1Cl Show InChI InChI=1S/C20H17ClFN5/c21-16-7-14(5-6-17(16)22)27-20-12(9-23)10-24-18-11-25-19(8-15(18)20)26-13-3-1-2-4-13/h5-8,10-11,13H,1-4H2,(H,24,27)(H,25,26) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against human Tpl2 kinase via quantification of MEK phosphorylation |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Proto-oncogene tyrosine-protein kinase Src
(Homo sapiens (Human)) | BDBM50173837
(6-(2-morpholinoethylamino)-4-(4-phenoxyphenylamino...)Show SMILES N#Cc1cnc2cnc(NCCN3CCOCC3)cc2c1Nc1ccc(Oc2ccccc2)cc1 Show InChI InChI=1S/C27H26N6O2/c28-17-20-18-30-25-19-31-26(29-10-11-33-12-14-34-15-13-33)16-24(25)27(20)32-21-6-8-23(9-7-21)35-22-4-2-1-3-5-22/h1-9,16,18-19H,10-15H2,(H,29,31)(H,30,32) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 9.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against Src |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
MAP kinase-activated protein kinase 2
(Homo sapiens (Human)) | BDBM50173832
(4-(3-chloro-4-fluorophenylamino)-6-(pyridin-3-ylme...)Show SMILES Fc1ccc(Nc2c(cnc3cnc(NCc4cccnc4)cc23)C#N)cc1Cl Show InChI InChI=1S/C21H14ClFN6/c22-17-6-15(3-4-18(17)23)29-21-14(8-24)11-26-19-12-28-20(7-16(19)21)27-10-13-2-1-5-25-9-13/h1-7,9,11-12H,10H2,(H,26,29)(H,27,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.10E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against MK2 |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
Proto-oncogene tyrosine-protein kinase Src
(Homo sapiens (Human)) | BDBM50173832
(4-(3-chloro-4-fluorophenylamino)-6-(pyridin-3-ylme...)Show SMILES Fc1ccc(Nc2c(cnc3cnc(NCc4cccnc4)cc23)C#N)cc1Cl Show InChI InChI=1S/C21H14ClFN6/c22-17-6-15(3-4-18(17)23)29-21-14(8-24)11-26-19-12-28-20(7-16(19)21)27-10-13-2-1-5-25-9-13/h1-7,9,11-12H,10H2,(H,26,29)(H,27,28) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >4.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against Src |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
MAP kinase-activated protein kinase 2
(Homo sapiens (Human)) | BDBM50173838
(4-(4-benzylphenylamino)-6-(2-morpholinoethylamino)...)Show SMILES N#Cc1cnc2cnc(NCCN3CCOCC3)cc2c1Nc1ccc(Cc2ccccc2)cc1 Show InChI InChI=1S/C28H28N6O/c29-18-23-19-31-26-20-32-27(30-10-11-34-12-14-35-15-13-34)17-25(26)28(23)33-24-8-6-22(7-9-24)16-21-4-2-1-3-5-21/h1-9,17,19-20H,10-16H2,(H,30,32)(H,31,33) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >4.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against MK2 |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
MAP kinase-activated protein kinase 2
(Homo sapiens (Human)) | BDBM29896
(1,7-naphthyridine-3-carbonitrile, 1 | CHEMBL197538)Show SMILES Fc1ccc(Nc2c(cnc3cnc(NCCN4CCOCC4)cc23)C#N)cc1Cl Show InChI InChI=1S/C21H20ClFN6O/c22-17-9-15(1-2-18(17)23)28-21-14(11-24)12-26-19-13-27-20(10-16(19)21)25-3-4-29-5-7-30-8-6-29/h1-2,9-10,12-13H,3-8H2,(H,25,27)(H,26,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >4.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against MK2 |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
MAP kinase-activated protein kinase 2
(Homo sapiens (Human)) | BDBM50173837
(6-(2-morpholinoethylamino)-4-(4-phenoxyphenylamino...)Show SMILES N#Cc1cnc2cnc(NCCN3CCOCC3)cc2c1Nc1ccc(Oc2ccccc2)cc1 Show InChI InChI=1S/C27H26N6O2/c28-17-20-18-30-25-19-31-26(29-10-11-33-12-14-34-15-13-33)16-24(25)27(20)32-21-6-8-23(9-7-21)35-22-4-2-1-3-5-22/h1-9,16,18-19H,10-15H2,(H,29,31)(H,30,32) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >4.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against MK2 |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
MAP kinase-activated protein kinase 2
(Homo sapiens (Human)) | BDBM50173833
(6-(2-morpholinoethylamino)-4-(4-(phenylthio)phenyl...)Show SMILES N#Cc1cnc2cnc(NCCN3CCOCC3)cc2c1Nc1ccc(Sc2ccccc2)cc1 Show InChI InChI=1S/C27H26N6OS/c28-17-20-18-30-25-19-31-26(29-10-11-33-12-14-34-15-13-33)16-24(25)27(20)32-21-6-8-23(9-7-21)35-22-4-2-1-3-5-22/h1-9,16,18-19H,10-15H2,(H,29,31)(H,30,32) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >4.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description
Inhibitory activity against MK2 |
Bioorg Med Chem Lett 15: 5288-92 (2005)
Article DOI: 10.1016/j.bmcl.2005.08.029
BindingDB Entry DOI: 10.7270/Q2JS9Q0M |
More data for this
Ligand-Target Pair | |
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