BindingDB logo
myBDB logout

Patent code US8802695

Compile Data Set for Download or QSAR
Found 41 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128404
PNG
(US8802695, 20)
Show SMILES CCn1cc(Br)c2cnc(NC(=O)c3ccc(cc3)[C@@](C)(O)CO)cc12 |r|
Show InChI InChI=1S/C19H20BrN3O3/c1-3-23-10-15(20)14-9-21-17(8-16(14)23)22-18(25)12-4-6-13(7-5-12)19(2,26)11-24/h4-10,24,26H,3,11H2,1-2H3,(H,21,22,25)/t19-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 2n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The test compounds (2.5 μL) dissolved in DMSO were added to wells containing 37.5 μL of the reaction solution (25 mM HEPES (pH 7.5), 10 mM ...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128406
PNG
(US8802695, 22)
Show SMILES C[C@](O)(CO)c1ccc(cc1)C(=O)Nc1cc2n(cc(Br)c2cn1)C1CC1 |r|
Show InChI InChI=1S/C20H20BrN3O3/c1-20(27,11-25)13-4-2-12(3-5-13)19(26)23-18-8-17-15(9-22-18)16(21)10-24(17)14-6-7-14/h2-5,8-10,14,25,27H,6-7,11H2,1H3,(H,22,23,26)/t20-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 2n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The test compounds (2.5 μL) dissolved in DMSO were added to wells containing 37.5 μL of the reaction solution (25 mM HEPES (pH 7.5), 10 mM ...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128395
PNG
(US8802695, 11)
Show SMILES CCn1cc(Br)c2cnc(NC(=O)c3ccc(cc3)C(C)(C)O)cc12
Show InChI InChI=1S/C19H20BrN3O2/c1-4-23-11-15(20)14-10-21-17(9-16(14)23)22-18(24)12-5-7-13(8-6-12)19(2,3)25/h5-11,25H,4H2,1-3H3,(H,21,22,24)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 3n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The test compounds (2.5 μL) dissolved in DMSO were added to wells containing 37.5 μL of the reaction solution (25 mM HEPES (pH 7.5), 10 mM ...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128394
PNG
(US8802695, 10)
Show SMILES CC(C)(O)c1ccc(cc1)C(=O)Nc1cc2n(CC3CC3)cc(Br)c2cn1
Show InChI InChI=1S/C21H22BrN3O2/c1-21(2,27)15-7-5-14(6-8-15)20(26)24-19-9-18-16(10-23-19)17(22)12-25(18)11-13-3-4-13/h5-10,12-13,27H,3-4,11H2,1-2H3,(H,23,24,26)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 3n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The test compounds (2.5 μL) dissolved in DMSO were added to wells containing 37.5 μL of the reaction solution (25 mM HEPES (pH 7.5), 10 mM ...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128407
PNG
(US8802695, 23)
Show SMILES C[C@](O)(CO)c1ccc(cc1)C(=O)Nc1cc2n(cc(Cl)c2cn1)C1CC1 |r|
Show InChI InChI=1S/C20H20ClN3O3/c1-20(27,11-25)13-4-2-12(3-5-13)19(26)23-18-8-17-15(9-22-18)16(21)10-24(17)14-6-7-14/h2-5,8-10,14,25,27H,6-7,11H2,1H3,(H,22,23,26)/t20-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 4n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The test compounds (2.5 μL) dissolved in DMSO were added to wells containing 37.5 μL of the reaction solution (25 mM HEPES (pH 7.5), 10 mM ...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128399
PNG
(US8802695, 15)
Show SMILES Cn1cc(Br)c2cnc(NC(=O)c3ccc(cc3)C(C)(C)O)cc12
Show InChI InChI=1S/C18H18BrN3O2/c1-18(2,24)12-6-4-11(5-7-12)17(23)21-16-8-15-13(9-20-16)14(19)10-22(15)3/h4-10,24H,1-3H3,(H,20,21,23)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 5n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The test compounds (2.5 μL) dissolved in DMSO were added to wells containing 37.5 μL of the reaction solution (25 mM HEPES (pH 7.5), 10 mM ...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128407
PNG
(US8802695, 23)
Show SMILES C[C@](O)(CO)c1ccc(cc1)C(=O)Nc1cc2n(cc(Cl)c2cn1)C1CC1 |r|
Show InChI InChI=1S/C20H20ClN3O3/c1-20(27,11-25)13-4-2-12(3-5-13)19(26)23-18-8-17-15(9-22-18)16(21)10-24(17)14-6-7-14/h2-5,8-10,14,25,27H,6-7,11H2,1H3,(H,22,23,26)/t20-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 6n/an/an/an/a7.325



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The inhibitory properties of compounds to ASK1 may be determined using a white 384-well-plate format under the following reaction conditions: 25 nM A...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128398
PNG
(US8802695, 14)
Show SMILES CCn1cc(Cl)c2cnc(NC(=O)c3ccc(cc3)[C@@](C)(O)CO)cc12 |r|
Show InChI InChI=1S/C19H20ClN3O3/c1-3-23-10-15(20)14-9-21-17(8-16(14)23)22-18(25)12-4-6-13(7-5-12)19(2,26)11-24/h4-10,24,26H,3,11H2,1-2H3,(H,21,22,25)/t19-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 6n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The test compounds (2.5 μL) dissolved in DMSO were added to wells containing 37.5 μL of the reaction solution (25 mM HEPES (pH 7.5), 10 mM ...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128396
PNG
(US8802695, 12)
Show SMILES CCn1cc(C)c2cnc(NC(=O)c3ccc(cc3)C(C)(C)O)cc12
Show InChI InChI=1S/C20H23N3O2/c1-5-23-12-13(2)16-11-21-18(10-17(16)23)22-19(24)14-6-8-15(9-7-14)20(3,4)25/h6-12,25H,5H2,1-4H3,(H,21,22,24)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 7n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The test compounds (2.5 μL) dissolved in DMSO were added to wells containing 37.5 μL of the reaction solution (25 mM HEPES (pH 7.5), 10 mM ...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128400
PNG
(US8802695, 16)
Show SMILES Cn1cc(Br)c2cnc(NC(=O)c3ccc(cc3)[C@@](C)(O)CO)cc12 |r|
Show InChI InChI=1S/C18H18BrN3O3/c1-18(25,10-23)12-5-3-11(4-6-12)17(24)21-16-7-15-13(8-20-16)14(19)9-22(15)2/h3-9,23,25H,10H2,1-2H3,(H,20,21,24)/t18-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 7n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The test compounds (2.5 μL) dissolved in DMSO were added to wells containing 37.5 μL of the reaction solution (25 mM HEPES (pH 7.5), 10 mM ...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128406
PNG
(US8802695, 22)
Show SMILES C[C@](O)(CO)c1ccc(cc1)C(=O)Nc1cc2n(cc(Br)c2cn1)C1CC1 |r|
Show InChI InChI=1S/C20H20BrN3O3/c1-20(27,11-25)13-4-2-12(3-5-13)19(26)23-18-8-17-15(9-22-18)16(21)10-24(17)14-6-7-14/h2-5,8-10,14,25,27H,6-7,11H2,1H3,(H,22,23,26)/t20-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 7n/an/an/an/a7.325



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The inhibitory properties of compounds to ASK1 may be determined using a white 384-well-plate format under the following reaction conditions: 25 nM A...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128395
PNG
(US8802695, 11)
Show SMILES CCn1cc(Br)c2cnc(NC(=O)c3ccc(cc3)C(C)(C)O)cc12
Show InChI InChI=1S/C19H20BrN3O2/c1-4-23-11-15(20)14-10-21-17(9-16(14)23)22-18(24)12-5-7-13(8-6-12)19(2,3)25/h5-11,25H,4H2,1-3H3,(H,21,22,24)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 8n/an/an/an/a7.325



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The inhibitory properties of compounds to ASK1 may be determined using a white 384-well-plate format under the following reaction conditions: 25 nM A...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128410
PNG
(US8802695, 26)
Show SMILES CCn1cc(Cl)c2cnc(NC(=O)c3ccc(cc3)[C@](C)(O)CO)cc12 |r|
Show InChI InChI=1S/C19H20ClN3O3/c1-3-23-10-15(20)14-9-21-17(8-16(14)23)22-18(25)12-4-6-13(7-5-12)19(2,26)11-24/h4-10,24,26H,3,11H2,1-2H3,(H,21,22,25)/t19-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 9n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The test compounds (2.5 μL) dissolved in DMSO were added to wells containing 37.5 μL of the reaction solution (25 mM HEPES (pH 7.5), 10 mM ...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128399
PNG
(US8802695, 15)
Show SMILES Cn1cc(Br)c2cnc(NC(=O)c3ccc(cc3)C(C)(C)O)cc12
Show InChI InChI=1S/C18H18BrN3O2/c1-18(2,24)12-6-4-11(5-7-12)17(23)21-16-8-15-13(9-20-16)14(19)10-22(15)3/h4-10,24H,1-3H3,(H,20,21,23)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 10n/an/an/an/a7.325



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The inhibitory properties of compounds to ASK1 may be determined using a white 384-well-plate format under the following reaction conditions: 25 nM A...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128404
PNG
(US8802695, 20)
Show SMILES CCn1cc(Br)c2cnc(NC(=O)c3ccc(cc3)[C@@](C)(O)CO)cc12 |r|
Show InChI InChI=1S/C19H20BrN3O3/c1-3-23-10-15(20)14-9-21-17(8-16(14)23)22-18(25)12-4-6-13(7-5-12)19(2,26)11-24/h4-10,24,26H,3,11H2,1-2H3,(H,21,22,25)/t19-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 10n/an/an/an/a7.325



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The inhibitory properties of compounds to ASK1 may be determined using a white 384-well-plate format under the following reaction conditions: 25 nM A...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128408
PNG
(US8802695, 24)
Show SMILES Cn1cc(Cl)c2cnc(NC(=O)c3ccc(cc3)C(C)(C)O)cc12
Show InChI InChI=1S/C18H18ClN3O2/c1-18(2,24)12-6-4-11(5-7-12)17(23)21-16-8-15-13(9-20-16)14(19)10-22(15)3/h4-10,24H,1-3H3,(H,20,21,23)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 11n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The test compounds (2.5 μL) dissolved in DMSO were added to wells containing 37.5 μL of the reaction solution (25 mM HEPES (pH 7.5), 10 mM ...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128410
PNG
(US8802695, 26)
Show SMILES CCn1cc(Cl)c2cnc(NC(=O)c3ccc(cc3)[C@](C)(O)CO)cc12 |r|
Show InChI InChI=1S/C19H20ClN3O3/c1-3-23-10-15(20)14-9-21-17(8-16(14)23)22-18(25)12-4-6-13(7-5-12)19(2,26)11-24/h4-10,24,26H,3,11H2,1-2H3,(H,21,22,25)/t19-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 12n/an/an/an/a7.325



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The inhibitory properties of compounds to ASK1 may be determined using a white 384-well-plate format under the following reaction conditions: 25 nM A...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128402
PNG
(US8802695, 18)
Show SMILES CCn1cc(C)c2cnc(NC(=O)c3ccc(cc3)[C@@](C)(O)CO)cc12 |r|
Show InChI InChI=1S/C20H23N3O3/c1-4-23-11-13(2)16-10-21-18(9-17(16)23)22-19(25)14-5-7-15(8-6-14)20(3,26)12-24/h5-11,24,26H,4,12H2,1-3H3,(H,21,22,25)/t20-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 14n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The test compounds (2.5 μL) dissolved in DMSO were added to wells containing 37.5 μL of the reaction solution (25 mM HEPES (pH 7.5), 10 mM ...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128398
PNG
(US8802695, 14)
Show SMILES CCn1cc(Cl)c2cnc(NC(=O)c3ccc(cc3)[C@@](C)(O)CO)cc12 |r|
Show InChI InChI=1S/C19H20ClN3O3/c1-3-23-10-15(20)14-9-21-17(8-16(14)23)22-18(25)12-4-6-13(7-5-12)19(2,26)11-24/h4-10,24,26H,3,11H2,1-2H3,(H,21,22,25)/t19-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 16n/an/an/an/a7.325



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The inhibitory properties of compounds to ASK1 may be determined using a white 384-well-plate format under the following reaction conditions: 25 nM A...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128412
PNG
(US8802695, 28)
Show SMILES CC(C)(CO)c1ccc(cc1)C(=O)Nc1cc2n(cc(Cl)c2cn1)C1CC1
Show InChI InChI=1S/C21H22ClN3O2/c1-21(2,12-26)14-5-3-13(4-6-14)20(27)24-19-9-18-16(10-23-19)17(22)11-25(18)15-7-8-15/h3-6,9-11,15,26H,7-8,12H2,1-2H3,(H,23,24,27)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 16n/an/an/an/a7.325



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The inhibitory properties of compounds to ASK1 may be determined using a white 384-well-plate format under the following reaction conditions: 25 nM A...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128402
PNG
(US8802695, 18)
Show SMILES CCn1cc(C)c2cnc(NC(=O)c3ccc(cc3)[C@@](C)(O)CO)cc12 |r|
Show InChI InChI=1S/C20H23N3O3/c1-4-23-11-13(2)16-10-21-18(9-17(16)23)22-19(25)14-5-7-15(8-6-14)20(3,26)12-24/h5-11,24,26H,4,12H2,1-3H3,(H,21,22,25)/t20-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 17n/an/an/an/a7.325



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The inhibitory properties of compounds to ASK1 may be determined using a white 384-well-plate format under the following reaction conditions: 25 nM A...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128408
PNG
(US8802695, 24)
Show SMILES Cn1cc(Cl)c2cnc(NC(=O)c3ccc(cc3)C(C)(C)O)cc12
Show InChI InChI=1S/C18H18ClN3O2/c1-18(2,24)12-6-4-11(5-7-12)17(23)21-16-8-15-13(9-20-16)14(19)10-22(15)3/h4-10,24H,1-3H3,(H,20,21,23)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 18n/an/an/an/a7.325



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The inhibitory properties of compounds to ASK1 may be determined using a white 384-well-plate format under the following reaction conditions: 25 nM A...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128403
PNG
(US8802695, 19)
Show SMILES Cc1cn(C)c2cc(NC(=O)c3ccc(cc3)C(C)(C)O)ncc12
Show InChI InChI=1S/C19H21N3O2/c1-12-11-22(4)16-9-17(20-10-15(12)16)21-18(23)13-5-7-14(8-6-13)19(2,3)24/h5-11,24H,1-4H3,(H,20,21,23)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 19n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The test compounds (2.5 μL) dissolved in DMSO were added to wells containing 37.5 μL of the reaction solution (25 mM HEPES (pH 7.5), 10 mM ...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128414
PNG
(US8802695, 31)
Show SMILES Cn1cc(Cl)c2cnc(NC(=O)c3ccc(cc3)[C@@](C)(O)CO)cc12 |r|
Show InChI InChI=1S/C18H18ClN3O3/c1-18(25,10-23)12-5-3-11(4-6-12)17(24)21-16-7-15-13(8-20-16)14(19)9-22(15)2/h3-9,23,25H,10H2,1-2H3,(H,20,21,24)/t18-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 19n/an/an/an/a7.325



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The inhibitory properties of compounds to ASK1 may be determined using a white 384-well-plate format under the following reaction conditions: 25 nM A...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128400
PNG
(US8802695, 16)
Show SMILES Cn1cc(Br)c2cnc(NC(=O)c3ccc(cc3)[C@@](C)(O)CO)cc12 |r|
Show InChI InChI=1S/C18H18BrN3O3/c1-18(25,10-23)12-5-3-11(4-6-12)17(24)21-16-7-15-13(8-20-16)14(19)9-22(15)2/h3-9,23,25H,10H2,1-2H3,(H,20,21,24)/t18-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 20n/an/an/an/a7.325



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The inhibitory properties of compounds to ASK1 may be determined using a white 384-well-plate format under the following reaction conditions: 25 nM A...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128396
PNG
(US8802695, 12)
Show SMILES CCn1cc(C)c2cnc(NC(=O)c3ccc(cc3)C(C)(C)O)cc12
Show InChI InChI=1S/C20H23N3O2/c1-5-23-12-13(2)16-11-21-18(10-17(16)23)22-19(24)14-6-8-15(9-7-14)20(3,4)25/h6-12,25H,5H2,1-4H3,(H,21,22,24)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 20n/an/an/an/a7.325



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The inhibitory properties of compounds to ASK1 may be determined using a white 384-well-plate format under the following reaction conditions: 25 nM A...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128403
PNG
(US8802695, 19)
Show SMILES Cc1cn(C)c2cc(NC(=O)c3ccc(cc3)C(C)(C)O)ncc12
Show InChI InChI=1S/C19H21N3O2/c1-12-11-22(4)16-9-17(20-10-15(12)16)21-18(23)13-5-7-14(8-6-13)19(2,3)24/h5-11,24H,1-4H3,(H,20,21,23)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 29n/an/an/an/a7.325



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The inhibitory properties of compounds to ASK1 may be determined using a white 384-well-plate format under the following reaction conditions: 25 nM A...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128413
PNG
(US8802695, 29)
Show SMILES Cn1cc(Cl)c2cnc(NC(=O)c3ccc(cc3)[C@](C)(O)CO)cc12 |r|
Show InChI InChI=1S/C18H18ClN3O3/c1-18(25,10-23)12-5-3-11(4-6-12)17(24)21-16-7-15-13(8-20-16)14(19)9-22(15)2/h3-9,23,25H,10H2,1-2H3,(H,20,21,24)/t18-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 38n/an/an/an/a7.325



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The inhibitory properties of compounds to ASK1 may be determined using a white 384-well-plate format under the following reaction conditions: 25 nM A...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128416
PNG
(US8802695, 33)
Show SMILES CCn1cc(Cl)c2cnc(NC(=O)c3ccc(c(C)c3)[C@@](C)(O)CO)cc12 |r|
Show InChI InChI=1S/C20H22ClN3O3/c1-4-24-10-16(21)14-9-22-18(8-17(14)24)23-19(26)13-5-6-15(12(2)7-13)20(3,27)11-25/h5-10,25,27H,4,11H2,1-3H3,(H,22,23,26)/t20-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 41n/an/an/an/a7.325



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The inhibitory properties of compounds to ASK1 may be determined using a white 384-well-plate format under the following reaction conditions: 25 nM A...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128397
PNG
(US8802695, 13)
Show SMILES CCn1ccc2cnc(NC(=O)c3ccc(cc3)[C@@](C)(O)CO)cc12 |r|
Show InChI InChI=1S/C19H21N3O3/c1-3-22-9-8-14-11-20-17(10-16(14)22)21-18(24)13-4-6-15(7-5-13)19(2,25)12-23/h4-11,23,25H,3,12H2,1-2H3,(H,20,21,24)/t19-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 55n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The test compounds (2.5 μL) dissolved in DMSO were added to wells containing 37.5 μL of the reaction solution (25 mM HEPES (pH 7.5), 10 mM ...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128409
PNG
(US8802695, 25)
Show SMILES Cn1c(Cl)c(Cl)c2cnc(NC(=O)c3ccc(cc3)C(C)(C)O)cc12
Show InChI InChI=1S/C18H17Cl2N3O2/c1-18(2,25)11-6-4-10(5-7-11)17(24)22-14-8-13-12(9-21-14)15(19)16(20)23(13)3/h4-9,25H,1-3H3,(H,21,22,24)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 60n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The test compounds (2.5 μL) dissolved in DMSO were added to wells containing 37.5 μL of the reaction solution (25 mM HEPES (pH 7.5), 10 mM ...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128394
PNG
(US8802695, 10)
Show SMILES CC(C)(O)c1ccc(cc1)C(=O)Nc1cc2n(CC3CC3)cc(Br)c2cn1
Show InChI InChI=1S/C21H22BrN3O2/c1-21(2,27)15-7-5-14(6-8-15)20(26)24-19-9-18-16(10-23-19)17(22)12-25(18)11-13-3-4-13/h5-10,12-13,27H,3-4,11H2,1-2H3,(H,23,24,26)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 62n/an/an/an/a7.325



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The inhibitory properties of compounds to ASK1 may be determined using a white 384-well-plate format under the following reaction conditions: 25 nM A...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128397
PNG
(US8802695, 13)
Show SMILES CCn1ccc2cnc(NC(=O)c3ccc(cc3)[C@@](C)(O)CO)cc12 |r|
Show InChI InChI=1S/C19H21N3O3/c1-3-22-9-8-14-11-20-17(10-16(14)22)21-18(24)13-4-6-15(7-5-13)19(2,25)12-23/h4-11,23,25H,3,12H2,1-2H3,(H,20,21,24)/t19-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 64n/an/an/an/a7.325



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The inhibitory properties of compounds to ASK1 may be determined using a white 384-well-plate format under the following reaction conditions: 25 nM A...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128401
PNG
(US8802695, 17)
Show SMILES C[C@](O)(CO)c1ccc(cc1)C(=O)Nc1cc2n(ccc2cn1)C1CC1 |r|
Show InChI InChI=1S/C20H21N3O3/c1-20(26,12-24)15-4-2-13(3-5-15)19(25)22-18-10-17-14(11-21-18)8-9-23(17)16-6-7-16/h2-5,8-11,16,24,26H,6-7,12H2,1H3,(H,21,22,25)/t20-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 69n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The test compounds (2.5 μL) dissolved in DMSO were added to wells containing 37.5 μL of the reaction solution (25 mM HEPES (pH 7.5), 10 mM ...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128393
PNG
(US8802695, 9)
Show SMILES CC(C)(O)c1ccc(cc1)C(=O)Nc1cc2n(CC3CC3)ccc2cn1
Show InChI InChI=1S/C21H23N3O2/c1-21(2,26)17-7-5-15(6-8-17)20(25)23-19-11-18-16(12-22-19)9-10-24(18)13-14-3-4-14/h5-12,14,26H,3-4,13H2,1-2H3,(H,22,23,25)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 81n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The test compounds (2.5 μL) dissolved in DMSO were added to wells containing 37.5 μL of the reaction solution (25 mM HEPES (pH 7.5), 10 mM ...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128415
PNG
(US8802695, 32)
Show SMILES Cn1c(Cl)c(Cl)c2cnc(NC(=O)c3ccc(cc3)[C@@](C)(O)CO)cc12 |r|
Show InChI InChI=1S/C18H17Cl2N3O3/c1-18(26,9-24)11-5-3-10(4-6-11)17(25)22-14-7-13-12(8-21-14)15(19)16(20)23(13)2/h3-8,24,26H,9H2,1-2H3,(H,21,22,25)/t18-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 122n/an/an/an/a7.325



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The inhibitory properties of compounds to ASK1 may be determined using a white 384-well-plate format under the following reaction conditions: 25 nM A...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128409
PNG
(US8802695, 25)
Show SMILES Cn1c(Cl)c(Cl)c2cnc(NC(=O)c3ccc(cc3)C(C)(C)O)cc12
Show InChI InChI=1S/C18H17Cl2N3O2/c1-18(2,25)11-6-4-10(5-7-11)17(24)22-14-8-13-12(9-21-14)15(19)16(20)23(13)3/h4-9,25H,1-3H3,(H,21,22,24)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 146n/an/an/an/a7.325



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The inhibitory properties of compounds to ASK1 may be determined using a white 384-well-plate format under the following reaction conditions: 25 nM A...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128401
PNG
(US8802695, 17)
Show SMILES C[C@](O)(CO)c1ccc(cc1)C(=O)Nc1cc2n(ccc2cn1)C1CC1 |r|
Show InChI InChI=1S/C20H21N3O3/c1-20(26,12-24)15-4-2-13(3-5-15)19(25)22-18-10-17-14(11-21-18)8-9-23(17)16-6-7-16/h2-5,8-11,16,24,26H,6-7,12H2,1H3,(H,21,22,25)/t20-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 214n/an/an/an/a7.325



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The inhibitory properties of compounds to ASK1 may be determined using a white 384-well-plate format under the following reaction conditions: 25 nM A...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128393
PNG
(US8802695, 9)
Show SMILES CC(C)(O)c1ccc(cc1)C(=O)Nc1cc2n(CC3CC3)ccc2cn1
Show InChI InChI=1S/C21H23N3O2/c1-21(2,26)17-7-5-15(6-8-17)20(25)23-19-11-18-16(12-22-19)9-10-24(18)13-14-3-4-14/h5-12,14,26H,3-4,13H2,1-2H3,(H,22,23,25)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 237n/an/an/an/a7.325



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The inhibitory properties of compounds to ASK1 may be determined using a white 384-well-plate format under the following reaction conditions: 25 nM A...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128411
PNG
(US8802695, 27)
Show SMILES CCn1ccc2cnc(NC(=O)c3ccc(c(C)c3)[C@@](C)(O)CO)cc12 |r|
Show InChI InChI=1S/C20H23N3O3/c1-4-23-8-7-15-11-21-18(10-17(15)23)22-19(25)14-5-6-16(13(2)9-14)20(3,26)12-24/h5-11,24,26H,4,12H2,1-3H3,(H,21,22,25)/t20-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 528n/an/an/an/a7.325



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The inhibitory properties of compounds to ASK1 may be determined using a white 384-well-plate format under the following reaction conditions: 25 nM A...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))
BDBM128405
PNG
(US8802695, 21)
Show SMILES CC(C)(O)c1ccc(cc1)C(=O)Nc1cc2n(CS(C)(=O)=O)ccc2cn1
Show InChI InChI=1S/C19H21N3O4S/c1-19(2,24)15-6-4-13(5-7-15)18(23)21-17-10-16-14(11-20-17)8-9-22(16)12-27(3,25)26/h4-11,24H,12H2,1-3H3,(H,20,21,23)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 1.24E+4n/an/an/an/a7.325



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The inhibitory properties of compounds to ASK1 may be determined using a white 384-well-plate format under the following reaction conditions: 25 nM A...


US Patent US8802695 (2014)


BindingDB Entry DOI: 10.7270/Q27W69WD
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%