SMILES String Search

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 19 hits in this display

Mitogen-activated protein kinase 14(Homo sapiens (Human))
Roche Palo Alto

Curated by ChEMBL

PNG

BDBM50341342(6-(2,4-difluorophenoxy)-8-methyl-2-(tetrahydro-2H-...)

IC50: 10nMAssay Description:Inhibition of human recombinant p38alpha assessed as incorporation of 33P from gamma-[33P]ATP into myelin basic protein after 30 mins by scintillatio...More data for this Ligand-Target Pair

PDB MMDB NCI pathway Reactome pathway KEGG
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PDB

3D Structure (crystal)

Cytochrome P450 3A4(Homo sapiens (Human))
Roche Palo Alto

Curated by ChEMBL

PNG

BDBM50341342(6-(2,4-difluorophenoxy)-8-methyl-2-(tetrahydro-2H-...)

IC50: >4.00E+4nMAssay Description:Inhibition of human CYP3A4More data for this Ligand-Target Pair

PDB MMDB Reactome pathway KEGG
UniProtKB/SwissProt
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Cytochrome P450 2D6(Homo sapiens (Human))
Roche Palo Alto

Curated by ChEMBL

PNG

BDBM50341342(6-(2,4-difluorophenoxy)-8-methyl-2-(tetrahydro-2H-...)

IC50: >4.00E+4nMAssay Description:Inhibition of human CYP2D6More data for this Ligand-Target Pair

PDB Reactome pathway
UniProtKB/SwissProt
GoogleScholar

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Cytochrome P450 2C19(Homo sapiens (Human))
Roche Palo Alto

Curated by ChEMBL

PNG

BDBM50341342(6-(2,4-difluorophenoxy)-8-methyl-2-(tetrahydro-2H-...)

IC50: >4.00E+4nMAssay Description:Inhibition of human CYP2C19More data for this Ligand-Target Pair

PDB MMDB Reactome pathway KEGG
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Cytochrome P450 2C9(Homo sapiens (Human))
Roche Palo Alto

Curated by ChEMBL

PNG

BDBM50341342(6-(2,4-difluorophenoxy)-8-methyl-2-(tetrahydro-2H-...)

IC50: >4.00E+4nMAssay Description:Inhibition of human CYP2C9More data for this Ligand-Target Pair

PDB MMDB Reactome pathway KEGG
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Cytochrome P450 1A2(Homo sapiens (Human))
Roche Palo Alto

Curated by ChEMBL

PNG

BDBM50341342(6-(2,4-difluorophenoxy)-8-methyl-2-(tetrahydro-2H-...)

IC50: >4.00E+4nMAssay Description:Inhibition of human CYP1A2More data for this Ligand-Target Pair

PDB MMDB Reactome pathway KEGG
UniProtKB/SwissProt
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Mitogen-activated protein kinase 8(Homo sapiens (Human))
Roche Palo Alto

Curated by ChEMBL

PNG

BDBM50341342(6-(2,4-difluorophenoxy)-8-methyl-2-(tetrahydro-2H-...)

Kd: 29nMAssay Description:Inhibition of JNK1More data for this Ligand-Target Pair

PDB MMDB NCI pathway Reactome pathway KEGG
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Mitogen-activated protein kinase 9(Homo sapiens (Human))
Roche Palo Alto

Curated by ChEMBL

PNG

BDBM50341342(6-(2,4-difluorophenoxy)-8-methyl-2-(tetrahydro-2H-...)

Kd: 9nMAssay Description:Inhibition of JNK2More data for this Ligand-Target Pair

PDB MMDB NCI pathway Reactome pathway KEGG
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Mitogen-activated protein kinase 10(Homo sapiens (Human))
Roche Palo Alto

Curated by ChEMBL

PNG

BDBM50341342(6-(2,4-difluorophenoxy)-8-methyl-2-(tetrahydro-2H-...)

Kd: 3nMAssay Description:Inhibition of JNK3More data for this Ligand-Target Pair

PDB MMDB NCI pathway Reactome pathway KEGG
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Serine/threonine-protein kinase NLK(Homo sapiens (Human))
Roche Palo Alto

Curated by ChEMBL

PNG

BDBM50341342(6-(2,4-difluorophenoxy)-8-methyl-2-(tetrahydro-2H-...)

Kd: 6nMAssay Description:Inhibition of NLKMore data for this Ligand-Target Pair

NCI pathway Reactome pathway KEGG
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Ribosomal protein S6 kinase alpha-3(Homo sapiens (Human))
Roche Palo Alto

Curated by ChEMBL

PNG

BDBM50341342(6-(2,4-difluorophenoxy)-8-methyl-2-(tetrahydro-2H-...)

Kd: 150nMAssay Description:Inhibition of RSK2More data for this Ligand-Target Pair

PDB MMDB Reactome pathway KEGG
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Ribosomal protein S6 kinase alpha-4(Homo sapiens (Human))
Roche Palo Alto

Curated by ChEMBL

PNG

BDBM50341342(6-(2,4-difluorophenoxy)-8-methyl-2-(tetrahydro-2H-...)

Kd: 73nMAssay Description:Inhibition of RSK4More data for this Ligand-Target Pair

NCI pathway Reactome pathway KEGG
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GoogleScholar

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Cyclin-G-associated kinase(Homo sapiens (Human))
Roche Palo Alto

Curated by ChEMBL

PNG

BDBM50341342(6-(2,4-difluorophenoxy)-8-methyl-2-(tetrahydro-2H-...)

Kd: 680nMAssay Description:Inhibition of GAKMore data for this Ligand-Target Pair

PDB MMDB Reactome pathway KEGG
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Epithelial discoidin domain-containing receptor 1(Homo sapiens (Human))
Roche Palo Alto

Curated by ChEMBL

PNG

BDBM50341342(6-(2,4-difluorophenoxy)-8-methyl-2-(tetrahydro-2H-...)

Kd: 270nMAssay Description:Inhibition of DDR1More data for this Ligand-Target Pair

PDB Reactome pathway KEGG
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Serine/threonine-protein kinase 36(Homo sapiens (Human))
Roche Palo Alto

Curated by ChEMBL

PNG

BDBM50341342(6-(2,4-difluorophenoxy)-8-methyl-2-(tetrahydro-2H-...)

Kd: 330nMAssay Description:Inhibition of STK36More data for this Ligand-Target Pair

NCI pathway KEGG
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Atypical kinase COQ8A, mitochondrial(Homo sapiens (Human))
Roche Palo Alto

Curated by ChEMBL

PNG

BDBM50341342(6-(2,4-difluorophenoxy)-8-methyl-2-(tetrahydro-2H-...)

Kd: 320nMAssay Description:Inhibition of ADCK3More data for this Ligand-Target Pair

PDB KEGG
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Mitogen-activated protein kinase 11(Homo sapiens (Human))
Roche Palo Alto

Curated by ChEMBL

PNG

BDBM50341342(6-(2,4-difluorophenoxy)-8-methyl-2-(tetrahydro-2H-...)

Kd: 29nMAssay Description:Inhibition of P38betaMore data for this Ligand-Target Pair

PDB MMDB Reactome pathway KEGG
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Mitogen-activated protein kinase 14(Homo sapiens (Human))
Roche Palo Alto

Curated by ChEMBL

PNG

BDBM50341342(6-(2,4-difluorophenoxy)-8-methyl-2-(tetrahydro-2H-...)

Kd: 0.200nMAssay Description:Inhibition of p38alphaMore data for this Ligand-Target Pair

PDB MMDB NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
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PDB

3D Structure (crystal)

Casein kinase I isoform epsilon(Homo sapiens (Human))
Roche Palo Alto

Curated by ChEMBL

PNG

BDBM50341342(6-(2,4-difluorophenoxy)-8-methyl-2-(tetrahydro-2H-...)

Kd: >1.00E+3nMAssay Description:Inhibition of CSNK1epsilonMore data for this Ligand-Target Pair

PDB Reactome pathway KEGG
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Filter my 19 hits

Targets 18▿
- Mitogen-activated protein kinase 14 2
- Cyclin-G-associated kinase 1
- Mitogen-activated protein kinase 11 1
- Mitogen-activated protein kinase 10 1
- Mitogen-activated protein kinase 9 1
- Ribosomal protein S6 kinase alpha-4 1
- Mitogen-activated protein kinase 8 1
- Serine/threonine-protein kinase 36 1
- Ribosomal protein S6 kinase alpha-3 1
- Serine/threonine-protein kinase NLK 1
- Cytochrome P450 1A2 1
- Epithelial discoidin domain-containing receptor 1 1
- Cytochrome P450 2C9 1
- Cytochrome P450 2C19 1
- Casein kinase I isoform epsilon 1
- Cytochrome P450 2D6 1
- Atypical kinase COQ8A, mitochondrial 1
- Cytochrome P450 3A4 1
Publications 1▿
- J Med Chem 54: 2255-65 (2011) 19
Institutions 1▿
- Roche Palo Alto 19
Affinity: 0.20 to 4.0E+4 nM▿
- IC50 6
- Kd 13
- Affinity ≤ nM
Xtal structures: 1
Docked structures: 0
Catalog Cmpds: 1