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Compile Data Set for Download or QSAR

Found 68 hits from Deciphera Pharmaceuticals LLC   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
cFMS


(Homo sapiens (Human))
BDBM181020
PNG
(US9133183, Example 29)
Show SMILES Cc1nc(NC(=O)N2CCN(C3CCCC3)C2=O)ccc1Oc1ccnc(c1)-c1cnn(C)c1
Show InChI InChI=1S/C24H27N7O3/c1-16-21(34-19-9-10-25-20(13-19)17-14-26-29(2)15-17)7-8-22(27-16)28-23(32)31-12-11-30(24(31)33)18-5-3-4-6-18/h7-10,13-15,18H,3-6,11-12H2,1-2H3,(H,27,28,32)
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n/an/a 2n/an/an/an/a7.530



Deciphera Pharmaceuticals LLC

US Patent


Assay Description
Activity of unphosphorylated c-FMS kinase (uFMS, Seq. ID no. 1) was determined by following the production of ADP from the FMS kinase reaction with A...


US Patent US9133183 (2015)


BindingDB Entry DOI: 10.7270/Q2DN43TD
More data for this
Ligand-Target Pair
cFMS


(Homo sapiens (Human))
BDBM181019
PNG
(US9133183, Example 15)
Show SMILES Cn1cc(cn1)-c1cc(Oc2ccc(NC(=O)N3CCN(C4CCCCC4)C3=O)nc2)ccn1
Show InChI InChI=1S/C24H27N7O3/c1-29-16-17(14-27-29)21-13-19(9-10-25-21)34-20-7-8-22(26-15-20)28-23(32)31-12-11-30(24(31)33)18-5-3-2-4-6-18/h7-10,13-16,18H,2-6,11-12H2,1H3,(H,26,28,32)
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n/an/a 3n/an/an/an/a7.530



Deciphera Pharmaceuticals LLC

US Patent


Assay Description
Activity of unphosphorylated c-FMS kinase (uFMS, Seq. ID no. 1) was determined by following the production of ADP from the FMS kinase reaction with A...


US Patent US9133183 (2015)


BindingDB Entry DOI: 10.7270/Q2DN43TD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50328774
PNG
(2-(3-(3-cyclopentyl-5-(3-(2,3-dichlorophenyl)ureid...)
Show SMILES NC(=O)Cc1cccc(c1)-n1nc(cc1NC(=O)Nc1cccc(Cl)c1Cl)C1CCCC1
Show InChI InChI=1S/C23H23Cl2N5O2/c24-17-9-4-10-18(22(17)25)27-23(32)28-21-13-19(15-6-1-2-7-15)29-30(21)16-8-3-5-14(11-16)12-20(26)31/h3-5,8-11,13,15H,1-2,6-7,12H2,(H2,26,31)(H2,27,28,32)
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n/an/a 5n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

Curated by ChEMBL


Assay Description
Binding affinity to unphosphorylated p38alpha by fluoroprobe binding assay


Bioorg Med Chem Lett 20: 5793-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.134
BindingDB Entry DOI: 10.7270/Q2XD11WK
More data for this
Ligand-Target Pair
cFMS


(Homo sapiens (Human))
BDBM181027
PNG
(US9133183, Example 90)
Show SMILES CNC(=O)c1cc(Oc2ccc(NC(=O)N3CCN(C3=O)C(C)(C)C)nc2)ccn1
Show InChI InChI=1S/C20H24N6O4/c1-20(2,3)26-10-9-25(19(26)29)18(28)24-16-6-5-14(12-23-16)30-13-7-8-22-15(11-13)17(27)21-4/h5-8,11-12H,9-10H2,1-4H3,(H,21,27)(H,23,24,28)
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n/an/a 5n/an/an/an/a7.530



Deciphera Pharmaceuticals LLC

US Patent


Assay Description
Activity of unphosphorylated c-FMS kinase (uFMS, Seq. ID no. 1) was determined by following the production of ADP from the FMS kinase reaction with A...


US Patent US9133183 (2015)


BindingDB Entry DOI: 10.7270/Q2DN43TD
More data for this
Ligand-Target Pair
cFMS


(Homo sapiens (Human))
BDBM181018
PNG
(US9133183, Example 1)
Show SMILES Cn1cc(cn1)-c1cc(Oc2ccc(NC(=O)N3CCN(C4CCOCC4)C3=O)nc2)ccn1
Show InChI InChI=1S/C23H25N7O4/c1-28-15-16(13-26-28)20-12-18(4-7-24-20)34-19-2-3-21(25-14-19)27-22(31)30-9-8-29(23(30)32)17-5-10-33-11-6-17/h2-4,7,12-15,17H,5-6,8-11H2,1H3,(H,25,27,31)
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n/an/a 6n/an/an/an/a7.530



Deciphera Pharmaceuticals LLC

US Patent


Assay Description
Activity of unphosphorylated c-FMS kinase (uFMS, Seq. ID no. 1) was determined by following the production of ADP from the FMS kinase reaction with A...


US Patent US9133183 (2015)


BindingDB Entry DOI: 10.7270/Q2DN43TD
More data for this
Ligand-Target Pair
cFMS


(Homo sapiens (Human))
BDBM181034
PNG
(US9133183, Example 91)
Show SMILES Cn1cc(cn1)-c1cc(Oc2cc(F)c(NC(=O)N3CCN(C4CCOCC4)C3=O)cc2F)ccn1
Show InChI InChI=1S/C24H24F2N6O4/c1-30-14-15(13-28-30)20-10-17(2-5-27-20)36-22-12-18(25)21(11-19(22)26)29-23(33)32-7-6-31(24(32)34)16-3-8-35-9-4-16/h2,5,10-14,16H,3-4,6-9H2,1H3,(H,29,33)
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n/an/a 7n/an/an/an/a7.530



Deciphera Pharmaceuticals LLC

US Patent


Assay Description
Activity of unphosphorylated c-FMS kinase (uFMS, Seq. ID no. 1) was determined by following the production of ADP from the FMS kinase reaction with A...


US Patent US9133183 (2015)


BindingDB Entry DOI: 10.7270/Q2DN43TD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50328768
PNG
(1-(5-tert-Butyl-2-{4-[2-(1,1-dioxo-1lambda6-thiomo...)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc(Cl)c2Cl)n(n1)-c1ccc(CC(=O)N2CCS(=O)(=O)CC2)cc1
Show InChI InChI=1S/C26H29Cl2N5O4S/c1-26(2,3)21-16-22(30-25(35)29-20-6-4-5-19(27)24(20)28)33(31-21)18-9-7-17(8-10-18)15-23(34)32-11-13-38(36,37)14-12-32/h4-10,16H,11-15H2,1-3H3,(H2,29,30,35)
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n/an/a 7n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

Curated by ChEMBL


Assay Description
Inhibition of p38alpha by fluoroprobe binding assay


Bioorg Med Chem Lett 20: 5793-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.134
BindingDB Entry DOI: 10.7270/Q2XD11WK
More data for this
Ligand-Target Pair
cFMS


(Homo sapiens (Human))
BDBM181037
PNG
(US9133183, Example 42)
Show SMILES CCN1CCN(C(=O)Nc2ccc(Oc3ccnc(c3)-c3cnn(C)c3)c(C)n2)C1=O
Show InChI InChI=1S/C21H23N7O3/c1-4-27-9-10-28(21(27)30)20(29)25-19-6-5-18(14(2)24-19)31-16-7-8-22-17(11-16)15-12-23-26(3)13-15/h5-8,11-13H,4,9-10H2,1-3H3,(H,24,25,29)
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n/an/a 8n/an/an/an/a7.530



Deciphera Pharmaceuticals LLC

US Patent


Assay Description
Activity of unphosphorylated c-FMS kinase (uFMS, Seq. ID no. 1) was determined by following the production of ADP from the FMS kinase reaction with A...


US Patent US9133183 (2015)


BindingDB Entry DOI: 10.7270/Q2DN43TD
More data for this
Ligand-Target Pair
cFMS


(Homo sapiens (Human))
BDBM181035
PNG
(US9133183, Example 101)
Show SMILES CN(C)C(=O)Nc1cc(Oc2cc(F)c(NC(=O)N3CCN(C4CCOCC4)C3=O)cc2Cl)ccn1
Show InChI InChI=1S/C23H26ClFN6O5/c1-29(2)21(32)28-20-11-15(3-6-26-20)36-19-13-17(25)18(12-16(19)24)27-22(33)31-8-7-30(23(31)34)14-4-9-35-10-5-14/h3,6,11-14H,4-5,7-10H2,1-2H3,(H,27,33)(H,26,28,32)
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n/an/a 8n/an/an/an/a7.530



Deciphera Pharmaceuticals LLC

US Patent


Assay Description
Activity of unphosphorylated c-FMS kinase (uFMS, Seq. ID no. 1) was determined by following the production of ADP from the FMS kinase reaction with A...


US Patent US9133183 (2015)


BindingDB Entry DOI: 10.7270/Q2DN43TD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50328755
PNG
(2-(3-(3-tert-butyl-5-(3-(2,3-dichlorophenyl)ureido...)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc(Cl)c2Cl)n(n1)-c1cccc(CC(N)=O)c1
Show InChI InChI=1S/C22H23Cl2N5O2/c1-22(2,3)17-12-19(27-21(31)26-16-9-5-8-15(23)20(16)24)29(28-17)14-7-4-6-13(10-14)11-18(25)30/h4-10,12H,11H2,1-3H3,(H2,25,30)(H2,26,27,31)
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n/an/a 9n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

Curated by ChEMBL


Assay Description
Binding affinity to unphosphorylated p38alpha by fluoroprobe binding assay


Bioorg Med Chem Lett 20: 5793-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.134
BindingDB Entry DOI: 10.7270/Q2XD11WK
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50328774
PNG
(2-(3-(3-cyclopentyl-5-(3-(2,3-dichlorophenyl)ureid...)
Show SMILES NC(=O)Cc1cccc(c1)-n1nc(cc1NC(=O)Nc1cccc(Cl)c1Cl)C1CCCC1
Show InChI InChI=1S/C23H23Cl2N5O2/c24-17-9-4-10-18(22(17)25)27-23(32)28-21-13-19(15-6-1-2-7-15)29-30(21)16-8-3-5-14(11-16)12-20(26)31/h3-5,8-11,13,15H,1-2,6-7,12H2,(H2,26,31)(H2,27,28,32)
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n/an/a 10n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

Curated by ChEMBL


Assay Description
Binding affinity to phosphorylated p38alpha by fluoroprobe binding assay


Bioorg Med Chem Lett 20: 5793-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.134
BindingDB Entry DOI: 10.7270/Q2XD11WK
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase


(Homo sapiens (Human))
BDBM50328755
PNG
(2-(3-(3-tert-butyl-5-(3-(2,3-dichlorophenyl)ureido...)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc(Cl)c2Cl)n(n1)-c1cccc(CC(N)=O)c1
Show InChI InChI=1S/C22H23Cl2N5O2/c1-22(2,3)17-12-19(27-21(31)26-16-9-5-8-15(23)20(16)24)29(28-17)14-7-4-6-13(10-14)11-18(25)30/h4-10,12H,11H2,1-3H3,(H2,25,30)(H2,26,27,31)
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n/an/a 11n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

Curated by ChEMBL


Assay Description
Inhibition of CRAF


Bioorg Med Chem Lett 20: 5793-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.134
BindingDB Entry DOI: 10.7270/Q2XD11WK
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50328755
PNG
(2-(3-(3-tert-butyl-5-(3-(2,3-dichlorophenyl)ureido...)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc(Cl)c2Cl)n(n1)-c1cccc(CC(N)=O)c1
Show InChI InChI=1S/C22H23Cl2N5O2/c1-22(2,3)17-12-19(27-21(31)26-16-9-5-8-15(23)20(16)24)29(28-17)14-7-4-6-13(10-14)11-18(25)30/h4-10,12H,11H2,1-3H3,(H2,25,30)(H2,26,27,31)
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n/an/a 11n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

Curated by ChEMBL


Assay Description
Binding affinity to phosphorylated p38alpha by fluoroprobe binding assay


Bioorg Med Chem Lett 20: 5793-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.134
BindingDB Entry DOI: 10.7270/Q2XD11WK
More data for this
Ligand-Target Pair
cFMS


(Homo sapiens (Human))
BDBM181023
PNG
(US9133183, Compound A)
Show SMILES Cn1cc(cn1)-c1cc(Oc2ccc(NC(=O)N3CCN(C3=O)c3ccc(F)cc3)nc2)ccn1
Show InChI InChI=1S/C24H20FN7O3/c1-30-15-16(13-28-30)21-12-19(8-9-26-21)35-20-6-7-22(27-14-20)29-23(33)32-11-10-31(24(32)34)18-4-2-17(25)3-5-18/h2-9,12-15H,10-11H2,1H3,(H,27,29,33)
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n/an/a 13n/an/an/an/a7.530



Deciphera Pharmaceuticals LLC

US Patent


Assay Description
Activity of unphosphorylated c-FMS kinase (uFMS, Seq. ID no. 1) was determined by following the production of ADP from the FMS kinase reaction with A...


US Patent US9133183 (2015)


BindingDB Entry DOI: 10.7270/Q2DN43TD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50328773
PNG
(2-(3-(5-(3-(2,3-dichlorophenyl)ureido)-3-(thiophen...)
Show SMILES NC(=O)Cc1cccc(c1)-n1nc(cc1NC(=O)Nc1cccc(Cl)c1Cl)-c1ccsc1
Show InChI InChI=1S/C22H17Cl2N5O2S/c23-16-5-2-6-17(21(16)24)26-22(31)27-20-11-18(14-7-8-32-12-14)28-29(20)15-4-1-3-13(9-15)10-19(25)30/h1-9,11-12H,10H2,(H2,25,30)(H2,26,27,31)
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n/an/a 15n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

Curated by ChEMBL


Assay Description
Binding affinity to unphosphorylated p38alpha by fluoroprobe binding assay


Bioorg Med Chem Lett 20: 5793-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.134
BindingDB Entry DOI: 10.7270/Q2XD11WK
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50328769
PNG
(2-(3-(3-tert-butyl-5-(3-naphthalen-1-ylureido)-1H-...)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc3ccccc23)n(n1)-c1cccc(CC(N)=O)c1
Show InChI InChI=1S/C26H27N5O2/c1-26(2,3)22-16-24(31(30-22)19-11-6-8-17(14-19)15-23(27)32)29-25(33)28-21-13-7-10-18-9-4-5-12-20(18)21/h4-14,16H,15H2,1-3H3,(H2,27,32)(H2,28,29,33)
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n/an/a 16n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

Curated by ChEMBL


Assay Description
Binding affinity to unphosphorylated p38alpha by fluoroprobe binding assay


Bioorg Med Chem Lett 20: 5793-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.134
BindingDB Entry DOI: 10.7270/Q2XD11WK
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))
BDBM192504
PNG
(US9187474, 76)
Show SMILES CNc1cc2nc(C)c(cc2cn1)-c1cc(NC(=O)NCCC(C)(C)F)c(F)cc1C
Show InChI InChI=1S/C23H27F2N5O/c1-13-8-18(24)20(30-22(31)27-7-6-23(3,4)25)10-16(13)17-9-15-12-28-21(26-5)11-19(15)29-14(17)2/h8-12H,6-7H2,1-5H3,(H,26,28)(H2,27,30,31)
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n/an/a 16n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

US Patent


Assay Description
Sample preparation: A375 cells from ATCC are lysed by sonication in commercially available lysis buffer, cleared by centrifugation, and the resulting...


US Patent US9187474 (2015)


BindingDB Entry DOI: 10.7270/Q2HH6HWK
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))
BDBM50328755
PNG
(2-(3-(3-tert-butyl-5-(3-(2,3-dichlorophenyl)ureido...)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc(Cl)c2Cl)n(n1)-c1cccc(CC(N)=O)c1
Show InChI InChI=1S/C22H23Cl2N5O2/c1-22(2,3)17-12-19(27-21(31)26-16-9-5-8-15(23)20(16)24)29(28-17)14-7-4-6-13(10-14)11-18(25)30/h4-10,12H,11H2,1-3H3,(H2,25,30)(H2,26,27,31)
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n/an/a 17n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

Curated by ChEMBL


Assay Description
Inhibition of BRAF


Bioorg Med Chem Lett 20: 5793-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.134
BindingDB Entry DOI: 10.7270/Q2XD11WK
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase


(Homo sapiens (Human))
BDBM192503
PNG
(US9187474, 18)
Show SMILES CNc1cc2nc(C)c(cc2cn1)-c1cc(NC(=O)NCCC(C)(C)C)ccc1F
Show InChI InChI=1S/C23H28FN5O/c1-14-17(10-15-13-27-21(25-5)12-20(15)28-14)18-11-16(6-7-19(18)24)29-22(30)26-9-8-23(2,3)4/h6-7,10-13H,8-9H2,1-5H3,(H,25,27)(H2,26,29,30)
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n/an/a 20n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

US Patent


Assay Description
Sample preparation: A375 cells from ATCC are lysed by sonication in commercially available lysis buffer, cleared by centrifugation, and the resulting...


US Patent US9187474 (2015)


BindingDB Entry DOI: 10.7270/Q2HH6HWK
More data for this
Ligand-Target Pair
cFMS


(Homo sapiens (Human))
BDBM181026
PNG
(US9133183, Example 18)
Show SMILES COCCN1CCN(C(=O)Nc2ccc(Oc3ccnc(c3)-c3cnn(C)c3)c(C)n2)C1=O
Show InChI InChI=1S/C22H25N7O4/c1-15-19(33-17-6-7-23-18(12-17)16-13-24-27(2)14-16)4-5-20(25-15)26-21(30)29-9-8-28(22(29)31)10-11-32-3/h4-7,12-14H,8-11H2,1-3H3,(H,25,26,30)
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n/an/a 20n/an/an/an/a7.530



Deciphera Pharmaceuticals LLC

US Patent


Assay Description
Activity of unphosphorylated c-FMS kinase (uFMS, Seq. ID no. 1) was determined by following the production of ADP from the FMS kinase reaction with A...


US Patent US9133183 (2015)


BindingDB Entry DOI: 10.7270/Q2DN43TD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50328769
PNG
(2-(3-(3-tert-butyl-5-(3-naphthalen-1-ylureido)-1H-...)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc3ccccc23)n(n1)-c1cccc(CC(N)=O)c1
Show InChI InChI=1S/C26H27N5O2/c1-26(2,3)22-16-24(31(30-22)19-11-6-8-17(14-19)15-23(27)32)29-25(33)28-21-13-7-10-18-9-4-5-12-20(18)21/h4-14,16H,15H2,1-3H3,(H2,27,32)(H2,28,29,33)
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n/an/a 22n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

Curated by ChEMBL


Assay Description
Binding affinity to phosphorylated p38alpha by fluoroprobe binding assay


Bioorg Med Chem Lett 20: 5793-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.134
BindingDB Entry DOI: 10.7270/Q2XD11WK
More data for this
Ligand-Target Pair
B-RAF V600E


(Homo sapiens (Human))
BDBM192504
PNG
(US9187474, 76)
Show SMILES CNc1cc2nc(C)c(cc2cn1)-c1cc(NC(=O)NCCC(C)(C)F)c(F)cc1C
Show InChI InChI=1S/C23H27F2N5O/c1-13-8-18(24)20(30-22(31)27-7-6-23(3,4)25)10-16(13)17-9-15-12-28-21(26-5)11-19(15)29-14(17)2/h8-12H,6-7H2,1-5H3,(H,26,28)(H2,27,30,31)
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n/an/a 22n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

US Patent


Assay Description
Sample preparation: A375 cells from ATCC are lysed by sonication in commercially available lysis buffer, cleared by centrifugation, and the resulting...


US Patent US9187474 (2015)


BindingDB Entry DOI: 10.7270/Q2HH6HWK
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50328771
PNG
(2-(3-(5-(3-(2,3-dichlorophenyl)ureido)-3-(2-fluoro...)
Show SMILES NC(=O)Cc1cccc(c1)-n1nc(cc1NC(=O)Nc1cccc(Cl)c1Cl)-c1ccccc1F
Show InChI InChI=1S/C24H18Cl2FN5O2/c25-17-8-4-10-19(23(17)26)29-24(34)30-22-13-20(16-7-1-2-9-18(16)27)31-32(22)15-6-3-5-14(11-15)12-21(28)33/h1-11,13H,12H2,(H2,28,33)(H2,29,30,34)
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n/an/a 25n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

Curated by ChEMBL


Assay Description
Binding affinity to unphosphorylated p38alpha by fluoroprobe binding assay


Bioorg Med Chem Lett 20: 5793-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.134
BindingDB Entry DOI: 10.7270/Q2XD11WK
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50328766
PNG
(1-(3-tert-butyl-1-(4-(hydroxymethyl)phenyl)-1H-pyr...)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc3ccccc23)n(n1)-c1ccc(CO)cc1
Show InChI InChI=1S/C25H26N4O2/c1-25(2,3)22-15-23(29(28-22)19-13-11-17(16-30)12-14-19)27-24(31)26-21-10-6-8-18-7-4-5-9-20(18)21/h4-15,30H,16H2,1-3H3,(H2,26,27,31)
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n/an/a 27n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

Curated by ChEMBL


Assay Description
Inhibition of p38alpha by fluoroprobe binding assay


Bioorg Med Chem Lett 20: 5793-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.134
BindingDB Entry DOI: 10.7270/Q2XD11WK
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50328773
PNG
(2-(3-(5-(3-(2,3-dichlorophenyl)ureido)-3-(thiophen...)
Show SMILES NC(=O)Cc1cccc(c1)-n1nc(cc1NC(=O)Nc1cccc(Cl)c1Cl)-c1ccsc1
Show InChI InChI=1S/C22H17Cl2N5O2S/c23-16-5-2-6-17(21(16)24)26-22(31)27-20-11-18(14-7-8-32-12-14)28-29(20)15-4-1-3-13(9-15)10-19(25)30/h1-9,11-12H,10H2,(H2,25,30)(H2,26,27,31)
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n/an/a 28n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

Curated by ChEMBL


Assay Description
Binding affinity to phosphorylated p38alpha by fluoroprobe binding assay


Bioorg Med Chem Lett 20: 5793-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.134
BindingDB Entry DOI: 10.7270/Q2XD11WK
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase A-Raf


(Homo sapiens (Human))
BDBM192503
PNG
(US9187474, 18)
Show SMILES CNc1cc2nc(C)c(cc2cn1)-c1cc(NC(=O)NCCC(C)(C)C)ccc1F
Show InChI InChI=1S/C23H28FN5O/c1-14-17(10-15-13-27-21(25-5)12-20(15)28-14)18-11-16(6-7-19(18)24)29-22(30)26-9-8-23(2,3)4/h6-7,10-13H,8-9H2,1-5H3,(H,25,27)(H2,26,29,30)
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n/an/a 31n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

US Patent


Assay Description
Sample preparation: A375 cells from ATCC are lysed by sonication in commercially available lysis buffer, cleared by centrifugation, and the resulting...


US Patent US9187474 (2015)


BindingDB Entry DOI: 10.7270/Q2HH6HWK
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))
BDBM192503
PNG
(US9187474, 18)
Show SMILES CNc1cc2nc(C)c(cc2cn1)-c1cc(NC(=O)NCCC(C)(C)C)ccc1F
Show InChI InChI=1S/C23H28FN5O/c1-14-17(10-15-13-27-21(25-5)12-20(15)28-14)18-11-16(6-7-19(18)24)29-22(30)26-9-8-23(2,3)4/h6-7,10-13H,8-9H2,1-5H3,(H,25,27)(H2,26,29,30)
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n/an/a 35n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

US Patent


Assay Description
Sample preparation: A375 cells from ATCC are lysed by sonication in commercially available lysis buffer, cleared by centrifugation, and the resulting...


US Patent US9187474 (2015)


BindingDB Entry DOI: 10.7270/Q2HH6HWK
More data for this
Ligand-Target Pair
B-RAF V600E


(Homo sapiens (Human))
BDBM192503
PNG
(US9187474, 18)
Show SMILES CNc1cc2nc(C)c(cc2cn1)-c1cc(NC(=O)NCCC(C)(C)C)ccc1F
Show InChI InChI=1S/C23H28FN5O/c1-14-17(10-15-13-27-21(25-5)12-20(15)28-14)18-11-16(6-7-19(18)24)29-22(30)26-9-8-23(2,3)4/h6-7,10-13H,8-9H2,1-5H3,(H,25,27)(H2,26,29,30)
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n/an/a 37n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

US Patent


Assay Description
Sample preparation: A375 cells from ATCC are lysed by sonication in commercially available lysis buffer, cleared by centrifugation, and the resulting...


US Patent US9187474 (2015)


BindingDB Entry DOI: 10.7270/Q2HH6HWK
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50328771
PNG
(2-(3-(5-(3-(2,3-dichlorophenyl)ureido)-3-(2-fluoro...)
Show SMILES NC(=O)Cc1cccc(c1)-n1nc(cc1NC(=O)Nc1cccc(Cl)c1Cl)-c1ccccc1F
Show InChI InChI=1S/C24H18Cl2FN5O2/c25-17-8-4-10-19(23(17)26)29-24(34)30-22-13-20(16-7-1-2-9-18(16)27)31-32(22)15-6-3-5-14(11-15)12-21(28)33/h1-11,13H,12H2,(H2,28,33)(H2,29,30,34)
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n/an/a 40n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

Curated by ChEMBL


Assay Description
Binding affinity to phosphorylated p38alpha by fluoroprobe binding assay


Bioorg Med Chem Lett 20: 5793-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.134
BindingDB Entry DOI: 10.7270/Q2XD11WK
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50328762
PNG
(1-(3-tert-butyl-1-(3-(2-morpholino-2-oxoethyl)phen...)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc3ccccc23)n(n1)-c1cccc(CC(=O)N2CCOCC2)c1
Show InChI InChI=1S/C30H33N5O3/c1-30(2,3)26-20-27(32-29(37)31-25-13-7-10-22-9-4-5-12-24(22)25)35(33-26)23-11-6-8-21(18-23)19-28(36)34-14-16-38-17-15-34/h4-13,18,20H,14-17,19H2,1-3H3,(H2,31,32,37)
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n/an/a 48n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

Curated by ChEMBL


Assay Description
Inhibition of p38alpha by fluoroprobe binding assay


Bioorg Med Chem Lett 20: 5793-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.134
BindingDB Entry DOI: 10.7270/Q2XD11WK
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50328772
PNG
(2-(3-(5-(3-(2,3-dichlorophenyl)ureido)-3-(thiophen...)
Show SMILES NC(=O)Cc1cccc(c1)-n1nc(cc1NC(=O)Nc1cccc(Cl)c1Cl)-c1cccs1
Show InChI InChI=1S/C22H17Cl2N5O2S/c23-15-6-2-7-16(21(15)24)26-22(31)27-20-12-17(18-8-3-9-32-18)28-29(20)14-5-1-4-13(10-14)11-19(25)30/h1-10,12H,11H2,(H2,25,30)(H2,26,27,31)
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n/an/a 48n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

Curated by ChEMBL


Assay Description
Binding affinity to unphosphorylated p38alpha by fluoroprobe binding assay


Bioorg Med Chem Lett 20: 5793-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.134
BindingDB Entry DOI: 10.7270/Q2XD11WK
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50328767
PNG
(3-(4-(3-tert-butyl-5-(3-naphthalen-1-ylureido)-1H-...)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc3ccccc23)n(n1)-c1ccc(CCC(O)=O)cc1
Show InChI InChI=1S/C27H28N4O3/c1-27(2,3)23-17-24(31(30-23)20-14-11-18(12-15-20)13-16-25(32)33)29-26(34)28-22-10-6-8-19-7-4-5-9-21(19)22/h4-12,14-15,17H,13,16H2,1-3H3,(H,32,33)(H2,28,29,34)
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n/an/a 50n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

Curated by ChEMBL


Assay Description
Inhibition of p38alpha by fluoroprobe binding assay


Bioorg Med Chem Lett 20: 5793-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.134
BindingDB Entry DOI: 10.7270/Q2XD11WK
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50327187
PNG
(1-{5-tert-Butyl-2-[3-(1,1,3-trioxo-1lambda*6*-[1,2...)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2ccc(Cl)cc2)n(n1)-c1cccc(CN2C(O)=CNS2(=O)=O)c1
Show InChI InChI=1S/C23H25ClN6O4S/c1-23(2,3)19-12-20(27-22(32)26-17-9-7-16(24)8-10-17)30(28-19)18-6-4-5-15(11-18)14-29-21(31)13-25-35(29,33)34/h4-13,25,31H,14H2,1-3H3,(H2,26,27,32)
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n/an/a 57n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

Curated by ChEMBL


Assay Description
Inhibition of p38alpha by fluoroprobe binding assay


Bioorg Med Chem Lett 20: 5793-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.134
BindingDB Entry DOI: 10.7270/Q2XD11WK
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50328772
PNG
(2-(3-(5-(3-(2,3-dichlorophenyl)ureido)-3-(thiophen...)
Show SMILES NC(=O)Cc1cccc(c1)-n1nc(cc1NC(=O)Nc1cccc(Cl)c1Cl)-c1cccs1
Show InChI InChI=1S/C22H17Cl2N5O2S/c23-15-6-2-7-16(21(15)24)26-22(31)27-20-12-17(18-8-3-9-32-18)28-29(20)14-5-1-4-13(10-14)11-19(25)30/h1-10,12H,11H2,(H2,25,30)(H2,26,27,31)
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n/an/a 66n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

Curated by ChEMBL


Assay Description
Binding affinity to phosphorylated p38alpha by fluoroprobe binding assay


Bioorg Med Chem Lett 20: 5793-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.134
BindingDB Entry DOI: 10.7270/Q2XD11WK
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50328763
PNG
(2-(3-(3-tert-butyl-5-(3-(4-chlorophenyl)ureido)-1H...)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2ccc(Cl)cc2)n(n1)-c1cccc(CC(N)=O)c1
Show InChI InChI=1S/C22H24ClN5O2/c1-22(2,3)18-13-20(26-21(30)25-16-9-7-15(23)8-10-16)28(27-18)17-6-4-5-14(11-17)12-19(24)29/h4-11,13H,12H2,1-3H3,(H2,24,29)(H2,25,26,30)
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n/an/a 68n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

Curated by ChEMBL


Assay Description
Inhibition of p38alpha by fluoroprobe binding assay


Bioorg Med Chem Lett 20: 5793-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.134
BindingDB Entry DOI: 10.7270/Q2XD11WK
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50328770
PNG
(2-(3-(5-(3-(2,3-dichlorophenyl)ureido)-3-phenyl-1H...)
Show SMILES NC(=O)Cc1cccc(c1)-n1nc(cc1NC(=O)Nc1cccc(Cl)c1Cl)-c1ccccc1
Show InChI InChI=1S/C24H19Cl2N5O2/c25-18-10-5-11-19(23(18)26)28-24(33)29-22-14-20(16-7-2-1-3-8-16)30-31(22)17-9-4-6-15(12-17)13-21(27)32/h1-12,14H,13H2,(H2,27,32)(H2,28,29,33)
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n/an/a 79n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

Curated by ChEMBL


Assay Description
Binding affinity to phosphorylated p38alpha by fluoroprobe binding assay


Bioorg Med Chem Lett 20: 5793-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.134
BindingDB Entry DOI: 10.7270/Q2XD11WK
More data for this
Ligand-Target Pair
Ephrin type-B receptor 2


(Homo sapiens (Human))
BDBM50328755
PNG
(2-(3-(3-tert-butyl-5-(3-(2,3-dichlorophenyl)ureido...)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc(Cl)c2Cl)n(n1)-c1cccc(CC(N)=O)c1
Show InChI InChI=1S/C22H23Cl2N5O2/c1-22(2,3)17-12-19(27-21(31)26-16-9-5-8-15(23)20(16)24)29(28-17)14-7-4-6-13(10-14)11-18(25)30/h4-10,12H,11H2,1-3H3,(H2,25,30)(H2,26,27,31)
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n/an/a 82n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

Curated by ChEMBL


Assay Description
Inhibition of EPHB2


Bioorg Med Chem Lett 20: 5793-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.134
BindingDB Entry DOI: 10.7270/Q2XD11WK
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50328770
PNG
(2-(3-(5-(3-(2,3-dichlorophenyl)ureido)-3-phenyl-1H...)
Show SMILES NC(=O)Cc1cccc(c1)-n1nc(cc1NC(=O)Nc1cccc(Cl)c1Cl)-c1ccccc1
Show InChI InChI=1S/C24H19Cl2N5O2/c25-18-10-5-11-19(23(18)26)28-24(33)29-22-14-20(16-7-2-1-3-8-16)30-31(22)17-9-4-6-15(12-17)13-21(27)32/h1-12,14H,13H2,(H2,27,32)(H2,28,29,33)
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n/an/a 119n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

Curated by ChEMBL


Assay Description
Binding affinity to unphosphorylated p38alpha by fluoroprobe binding assay


Bioorg Med Chem Lett 20: 5793-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.134
BindingDB Entry DOI: 10.7270/Q2XD11WK
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase A-Raf


(Homo sapiens (Human))
BDBM192504
PNG
(US9187474, 76)
Show SMILES CNc1cc2nc(C)c(cc2cn1)-c1cc(NC(=O)NCCC(C)(C)F)c(F)cc1C
Show InChI InChI=1S/C23H27F2N5O/c1-13-8-18(24)20(30-22(31)27-7-6-23(3,4)25)10-16(13)17-9-15-12-28-21(26-5)11-19(15)29-14(17)2/h8-12H,6-7H2,1-5H3,(H,26,28)(H2,27,30,31)
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n/an/a 120n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

US Patent


Assay Description
Sample preparation: A375 cells from ATCC are lysed by sonication in commercially available lysis buffer, cleared by centrifugation, and the resulting...


US Patent US9187474 (2015)


BindingDB Entry DOI: 10.7270/Q2HH6HWK
More data for this
Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase


(Homo sapiens (Human))
BDBM192504
PNG
(US9187474, 76)
Show SMILES CNc1cc2nc(C)c(cc2cn1)-c1cc(NC(=O)NCCC(C)(C)F)c(F)cc1C
Show InChI InChI=1S/C23H27F2N5O/c1-13-8-18(24)20(30-22(31)27-7-6-23(3,4)25)10-16(13)17-9-15-12-28-21(26-5)11-19(15)29-14(17)2/h8-12H,6-7H2,1-5H3,(H,26,28)(H2,27,30,31)
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n/an/a 170n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

US Patent


Assay Description
Sample preparation: A375 cells from ATCC are lysed by sonication in commercially available lysis buffer, cleared by centrifugation, and the resulting...


US Patent US9187474 (2015)


BindingDB Entry DOI: 10.7270/Q2HH6HWK
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM181023
PNG
(US9133183, Compound A)
Show SMILES Cn1cc(cn1)-c1cc(Oc2ccc(NC(=O)N3CCN(C3=O)c3ccc(F)cc3)nc2)ccn1
Show InChI InChI=1S/C24H20FN7O3/c1-30-15-16(13-28-30)21-12-19(8-9-26-21)35-20-6-7-22(27-14-20)29-23(33)32-11-10-31(24(32)34)18-4-2-17(25)3-5-18/h2-9,12-15H,10-11H2,1H3,(H,27,29,33)
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n/an/a 196n/an/an/an/an/a27



Deciphera Pharmaceuticals LLC

US Patent


Assay Description
These tests measure the ability of compounds to inhibit the enzymatic activity of recombinant human c-Met/HGF receptor and VEGF receptor enzymatic ac...


US Patent US9133183 (2015)


BindingDB Entry DOI: 10.7270/Q2DN43TD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50328756
PNG
(1-(3-tert-butyl-1-(3-((1-methyl-3,5-dioxo-1,2,4-tr...)
Show SMILES Cn1[nH]c(=O)n(Cc2cccc(c2)-n2nc(cc2NC(=O)Nc2cccc3ccccc23)C(C)(C)C)c1=O
Show InChI InChI=1S/C28H29N7O3/c1-28(2,3)23-16-24(30-25(36)29-22-14-8-11-19-10-5-6-13-21(19)22)35(31-23)20-12-7-9-18(15-20)17-34-26(37)32-33(4)27(34)38/h5-16H,17H2,1-4H3,(H,32,37)(H2,29,30,36)
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n/an/a 292n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

Curated by ChEMBL


Assay Description
Inhibition of p38alpha by fluoroprobe binding assay


Bioorg Med Chem Lett 20: 5793-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.134
BindingDB Entry DOI: 10.7270/Q2XD11WK
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM181019
PNG
(US9133183, Example 15)
Show SMILES Cn1cc(cn1)-c1cc(Oc2ccc(NC(=O)N3CCN(C4CCCCC4)C3=O)nc2)ccn1
Show InChI InChI=1S/C24H27N7O3/c1-29-16-17(14-27-29)21-13-19(9-10-25-21)34-20-7-8-22(26-15-20)28-23(32)31-12-11-30(24(31)33)18-5-3-2-4-6-18/h7-10,13-16,18H,2-6,11-12H2,1H3,(H,26,28,32)
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n/an/a 370n/an/an/an/an/a27



Deciphera Pharmaceuticals LLC

US Patent


Assay Description
These tests measure the ability of compounds to inhibit the enzymatic activity of recombinant human c-Met/HGF receptor and VEGF receptor enzymatic ac...


US Patent US9133183 (2015)


BindingDB Entry DOI: 10.7270/Q2DN43TD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50328757
PNG
(1-(3-tert-butyl-1-(3-((4,4-dimethyl-3,5-dioxopyraz...)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc3ccccc23)n(n1)-c1cccc(CN2NC(=O)C(C)(C)C2=O)c1
Show InChI InChI=1S/C30H32N6O3/c1-29(2,3)24-17-25(32-28(39)31-23-15-9-12-20-11-6-7-14-22(20)23)36(33-24)21-13-8-10-19(16-21)18-35-27(38)30(4,5)26(37)34-35/h6-17H,18H2,1-5H3,(H,34,37)(H2,31,32,39)
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n/an/a 384n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

Curated by ChEMBL


Assay Description
Inhibition of p38alpha by fluoroprobe binding assay


Bioorg Med Chem Lett 20: 5793-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.134
BindingDB Entry DOI: 10.7270/Q2XD11WK
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50328759
PNG
(1-(1-(3-(2-aminoethyl)phenyl)-3-tert-butyl-1H-pyra...)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2ccc(Cl)cc2)n(n1)-c1cccc(CCN)c1
Show InChI InChI=1S/C22H26ClN5O/c1-22(2,3)19-14-20(26-21(29)25-17-9-7-16(23)8-10-17)28(27-19)18-6-4-5-15(13-18)11-12-24/h4-10,13-14H,11-12,24H2,1-3H3,(H2,25,26,29)
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n/an/a 508n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

Curated by ChEMBL


Assay Description
Inhibition of p38alpha by fluoroprobe binding assay


Bioorg Med Chem Lett 20: 5793-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.134
BindingDB Entry DOI: 10.7270/Q2XD11WK
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM181019
PNG
(US9133183, Example 15)
Show SMILES Cn1cc(cn1)-c1cc(Oc2ccc(NC(=O)N3CCN(C4CCCCC4)C3=O)nc2)ccn1
Show InChI InChI=1S/C24H27N7O3/c1-29-16-17(14-27-29)21-13-19(9-10-25-21)34-20-7-8-22(26-15-20)28-23(32)31-12-11-30(24(31)33)18-5-3-2-4-6-18/h7-10,13-16,18H,2-6,11-12H2,1H3,(H,26,28,32)
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n/an/a 670n/an/an/an/an/a27



Deciphera Pharmaceuticals LLC

US Patent


Assay Description
These tests measure the ability of compounds to inhibit the enzymatic activity of recombinant human c-Met/HGF receptor and VEGF receptor enzymatic ac...


US Patent US9133183 (2015)


BindingDB Entry DOI: 10.7270/Q2DN43TD
More data for this
Ligand-Target Pair
Hepatocyte growth factor receptor


(Homo sapiens (Human))
BDBM181020
PNG
(US9133183, Example 29)
Show SMILES Cc1nc(NC(=O)N2CCN(C3CCCC3)C2=O)ccc1Oc1ccnc(c1)-c1cnn(C)c1
Show InChI InChI=1S/C24H27N7O3/c1-16-21(34-19-9-10-25-20(13-19)17-14-26-29(2)15-17)7-8-22(27-16)28-23(32)31-12-11-30(24(31)33)18-5-3-4-6-18/h7-10,13-15,18H,3-6,11-12H2,1-2H3,(H,27,28,32)
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n/an/a 898n/an/an/an/an/a27



Deciphera Pharmaceuticals LLC

US Patent


Assay Description
These tests measure the ability of compounds to inhibit the enzymatic activity of recombinant human c-Met/HGF receptor and VEGF receptor enzymatic ac...


US Patent US9133183 (2015)


BindingDB Entry DOI: 10.7270/Q2DN43TD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50328760
PNG
(3-(3-tert-butyl-5-(3-naphthalen-1-ylureido)-1H-pyr...)
Show SMILES CNC(=O)CNC(=O)CNC(=O)c1cccc(c1)-n1nc(cc1NC(=O)Nc1cccc2ccccc12)C(C)(C)C
Show InChI InChI=1S/C30H33N7O4/c1-30(2,3)24-16-25(35-29(41)34-23-14-8-10-19-9-5-6-13-22(19)23)37(36-24)21-12-7-11-20(15-21)28(40)33-18-27(39)32-17-26(38)31-4/h5-16H,17-18H2,1-4H3,(H,31,38)(H,32,39)(H,33,40)(H2,34,35,41)
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n/an/a 949n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

Curated by ChEMBL


Assay Description
Inhibition of p38alpha by fluoroprobe binding assay


Bioorg Med Chem Lett 20: 5793-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.134
BindingDB Entry DOI: 10.7270/Q2XD11WK
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM181023
PNG
(US9133183, Compound A)
Show SMILES Cn1cc(cn1)-c1cc(Oc2ccc(NC(=O)N3CCN(C3=O)c3ccc(F)cc3)nc2)ccn1
Show InChI InChI=1S/C24H20FN7O3/c1-30-15-16(13-28-30)21-12-19(8-9-26-21)35-20-6-7-22(27-14-20)29-23(33)32-11-10-31(24(32)34)18-4-2-17(25)3-5-18/h2-9,12-15H,10-11H2,1H3,(H,27,29,33)
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n/an/a 990n/an/an/an/an/a27



Deciphera Pharmaceuticals LLC

US Patent


Assay Description
These tests measure the ability of compounds to inhibit the enzymatic activity of recombinant human c-Met/HGF receptor and VEGF receptor enzymatic ac...


US Patent US9133183 (2015)


BindingDB Entry DOI: 10.7270/Q2DN43TD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50328758
PNG
(CHEMBL1270557 | N-(N-(3-(3-tert-butyl-5-(3-(4-chlo...)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2ccc(Cl)cc2)n(n1)-c1cccc(CNS(=O)(=O)NC(=O)N2CCCC2)c1
Show InChI InChI=1S/C26H32ClN7O4S/c1-26(2,3)22-16-23(30-24(35)29-20-11-9-19(27)10-12-20)34(31-22)21-8-6-7-18(15-21)17-28-39(37,38)32-25(36)33-13-4-5-14-33/h6-12,15-16,28H,4-5,13-14,17H2,1-3H3,(H,32,36)(H2,29,30,35)
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n/an/a 1.11E+3n/an/an/an/an/an/a



Deciphera Pharmaceuticals LLC

Curated by ChEMBL


Assay Description
Inhibition of p38alpha by fluoroprobe binding assay


Bioorg Med Chem Lett 20: 5793-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.134
BindingDB Entry DOI: 10.7270/Q2XD11WK
More data for this
Ligand-Target Pair
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