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PubMed code 31121430

Compile data set for download or QSAR
Found 22 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
Dual specificity protein kinase TTK


(Homo sapiens (Human))		BDBM50512455
PNG
(CHEMBL4436510)
Show SMILES Cc1nc(ccc1Nc1nc(NC(C)(C)CO)c2c(c[nH]c2n1)C#N)N1CCOCC1
Show InChI InChI=1S/C21H26N8O2/c1-13-15(4-5-16(24-13)29-6-8-31-9-7-29)25-20-26-18-17(14(10-22)11-23-18)19(27-20)28-21(2,3)12-30/h4-5,11,30H,6-9,12H2,1-3H3,(H3,23,25,26,27,28)
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<0.5n/an/an/an/an/an/an/an/a



Jilin University

Curated by ChEMBL


Assay Description
Inhibition of MPS1 (510 to 857 residues) catalytic domain (unknown origin) expressed in Escherichia coli after 15 mins by mass-spectrometry analysis

Eur J Med Chem 175: 247-268 (2019)


Article DOI: 10.1016/j.ejmech.2019.04.047
BindingDB Entry DOI: 10.7270/Q21V5J8N
More data for this
Ligand-Target Pair
Dual specificity protein kinase TTK


(Homo sapiens (Human))		BDBM50512458
PNG
(CHEMBL4450240)
Show SMILES Cc1nc(ccc1Nc1nc(NC2CCOCC2)c2c(c[nH]c2n1)C#N)N1CCOCC1
Show InChI InChI=1S/C22H26N8O2/c1-14-17(2-3-18(25-14)30-6-10-32-11-7-30)27-22-28-20-19(15(12-23)13-24-20)21(29-22)26-16-4-8-31-9-5-16/h2-3,13,16H,4-11H2,1H3,(H3,24,26,27,28,29)
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<0.5n/an/an/an/an/an/an/an/a



Jilin University

Curated by ChEMBL


Assay Description
Inhibition of MPS1 (510 to 857 residues) catalytic domain (unknown origin) expressed in Escherichia coli after 15 mins by mass-spectrometry analysis

Eur J Med Chem 175: 247-268 (2019)


Article DOI: 10.1016/j.ejmech.2019.04.047
BindingDB Entry DOI: 10.7270/Q21V5J8N
More data for this
Ligand-Target Pair
Dual specificity protein kinase TTK


(Homo sapiens (Human))		BDBM329334
PNG
((2R)-2-(4-fluorophenyl)-N-[4-(2-{[2-methoxy-4-(met...)
Show SMILES COc1cc(ccc1Nc1nc2ccc(cn2n1)-c1ccc(NC(=O)[C@H](C)c2ccc(F)cc2)cc1)S(C)(=O)=O |r|
Show InChI InChI=1S/C29H26FN5O4S/c1-18(19-4-9-22(30)10-5-19)28(36)31-23-11-6-20(7-12-23)21-8-15-27-33-29(34-35(27)17-21)32-25-14-13-24(40(3,37)38)16-26(25)39-2/h4-18H,1-3H3,(H,31,36)(H,32,34)/t18-/m1/s1
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n/an/a 0.340n/an/an/an/an/an/a



Jilin University

Curated by ChEMBL


Assay Description
Inhibition of MPS1 (unknown origin) using biotin-AhxPWDPDDADITEILG-NH2 as substrate preincubated for 15 mins followed by substrate addition by TR-FRE...

Eur J Med Chem 175: 247-268 (2019)


Article DOI: 10.1016/j.ejmech.2019.04.047
BindingDB Entry DOI: 10.7270/Q21V5J8N
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Dual specificity protein kinase TTK


(Homo sapiens (Human))		BDBM258444
PNG
(US9512130, 2)
Show SMILES COc1ccc(Oc2cc(NCCC(F)(F)F)c3ncc(-c4ccc(C(=O)NC5CC5)c(C)c4)n3n2)c(F)c1F
Show InChI InChI=1S/C27H24F5N5O3/c1-14-11-15(3-6-17(14)26(38)35-16-4-5-16)19-13-34-25-18(33-10-9-27(30,31)32)12-22(36-37(19)25)40-21-8-7-20(39-2)23(28)24(21)29/h3,6-8,11-13,16,33H,4-5,9-10H2,1-2H3,(H,35,38)
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n/an/a 0.630n/an/an/an/an/an/a



Jilin University

Curated by ChEMBL


Assay Description
Inhibition of MPS1 (unknown origin) using biotin-AhxPWDPDDADITEILG-NH2 as substrate preincubated for 15 mins followed by substrate addition by TR-FRE...

Eur J Med Chem 175: 247-268 (2019)


Article DOI: 10.1016/j.ejmech.2019.04.047
BindingDB Entry DOI: 10.7270/Q21V5J8N
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Dual specificity protein kinase TTK


(Homo sapiens (Human))		BDBM50072911
PNG
(CHEMBL3410084)
Show SMILES CC(C)(Nc1cc(NCC2CCOCC2)c2ncc(-c3ccc(cc3)C(=O)NC3CC3)n2n1)C(F)(F)F
Show InChI InChI=1S/C26H31F3N6O2/c1-25(2,26(27,28)29)33-22-13-20(30-14-16-9-11-37-12-10-16)23-31-15-21(35(23)34-22)17-3-5-18(6-4-17)24(36)32-19-7-8-19/h3-6,13,15-16,19,30H,7-12,14H2,1-2H3,(H,32,36)(H,33,34)
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n/an/a 0.700n/an/an/an/an/an/a



Jilin University

Curated by ChEMBL


Assay Description
Inhibition of MPS1 (unknown origin) by cell based assay

Eur J Med Chem 175: 247-268 (2019)


Article DOI: 10.1016/j.ejmech.2019.04.047
BindingDB Entry DOI: 10.7270/Q21V5J8N
More data for this
Ligand-Target Pair
Dual specificity protein kinase TTK


(Homo sapiens (Human))		BDBM50512459
PNG
(CHEMBL4581793)
Show SMILES O=C(Cc1ccccc1)Nc1ccc(cc1)-c1ccc2nc(Nc3ccccc3C#N)nn2c1
Show InChI InChI=1S/C27H20N6O/c28-17-21-8-4-5-9-24(21)30-27-31-25-15-12-22(18-33(25)32-27)20-10-13-23(14-11-20)29-26(34)16-19-6-2-1-3-7-19/h1-15,18H,16H2,(H,29,34)(H,30,32)
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n/an/a 1n/an/an/an/an/an/a



Jilin University

Curated by ChEMBL


Assay Description
Inhibition of MPS1 (unknown origin)

Eur J Med Chem 175: 247-268 (2019)


Article DOI: 10.1016/j.ejmech.2019.04.047
BindingDB Entry DOI: 10.7270/Q21V5J8N
More data for this
Ligand-Target Pair
Dual specificity protein kinase TTK


(Homo sapiens (Human))		BDBM50512456
PNG
(CHEMBL4469414)
Show SMILES Cc1cc(ccc1C(=O)NC1CC1)-c1cnn2c(NC[C@H]3C[C@@](C)(O)C3)cc(Oc3cccnc3)nc12 |r,wU:20.21,22.25,(48.46,-32.37,;49.53,-31.26,;49.1,-29.78,;50.17,-28.67,;51.66,-29.03,;52.09,-30.5,;51.03,-31.63,;51.46,-33.1,;50.39,-34.22,;52.95,-33.47,;54.02,-32.36,;55.49,-31.92,;54.38,-30.85,;49.74,-27.2,;50.69,-25.98,;49.82,-24.7,;48.34,-25.14,;47.04,-24.33,;47.09,-22.79,;45.78,-21.98,;44.42,-22.71,;43.98,-24.18,;42.51,-23.74,;41.01,-23.33,;41.41,-24.82,;42.95,-22.26,;45.69,-25.06,;45.64,-26.6,;44.29,-27.33,;44.25,-28.87,;42.89,-29.59,;42.85,-31.13,;44.16,-31.94,;45.52,-31.2,;45.56,-29.66,;46.95,-27.4,;48.29,-26.68,)|
Show InChI InChI=1S/C28H30N6O3/c1-17-10-19(5-8-22(17)27(35)32-20-6-7-20)23-16-31-34-24(30-14-18-12-28(2,36)13-18)11-25(33-26(23)34)37-21-4-3-9-29-15-21/h3-5,8-11,15-16,18,20,30,36H,6-7,12-14H2,1-2H3,(H,32,35)/t18-,28+
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n/an/a 1.20n/an/an/an/an/an/a



Jilin University

Curated by ChEMBL


Assay Description
Inhibition of MPS1 (unknown origin)

Eur J Med Chem 175: 247-268 (2019)


Article DOI: 10.1016/j.ejmech.2019.04.047
BindingDB Entry DOI: 10.7270/Q21V5J8N
More data for this
Ligand-Target Pair
Dual specificity protein kinase TTK


(Homo sapiens (Human))		BDBM50072900
PNG
(CHEMBL3410073)
Show SMILES Nc1cc(ccc1-c1cc(NCC2CCOCC2)c2ncc(-c3ccc(cc3)C(=O)NC3CC3)n2n1)C#N
Show InChI InChI=1S/C29H29N7O2/c30-15-19-1-8-23(24(31)13-19)25-14-26(32-16-18-9-11-38-12-10-18)28-33-17-27(36(28)35-25)20-2-4-21(5-3-20)29(37)34-22-6-7-22/h1-5,8,13-14,17-18,22,32H,6-7,9-12,16,31H2,(H,34,37)
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n/an/a 1.30n/an/an/an/an/an/a



Jilin University

Curated by ChEMBL


Assay Description
Inhibition of MPS1 (unknown origin) by cell based assay

Eur J Med Chem 175: 247-268 (2019)


Article DOI: 10.1016/j.ejmech.2019.04.047
BindingDB Entry DOI: 10.7270/Q21V5J8N
More data for this
Ligand-Target Pair
Dual specificity protein kinase TTK


(Homo sapiens (Human))		BDBM50072833
PNG
(CHEMBL3410060 | US11208696, Example 2)
Show SMILES CC(C)CNc1nccn2c(cnc12)-c1ccc(cc1)C(=O)NC1CC1
Show InChI InChI=1S/C20H23N5O/c1-13(2)11-22-18-19-23-12-17(25(19)10-9-21-18)14-3-5-15(6-4-14)20(26)24-16-7-8-16/h3-6,9-10,12-13,16H,7-8,11H2,1-2H3,(H,21,22)(H,24,26)
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n/an/a 1.40n/an/an/an/an/an/a



Jilin University

Curated by ChEMBL


Assay Description
Inhibition of MPS1 (unknown origin)

Eur J Med Chem 175: 247-268 (2019)


Article DOI: 10.1016/j.ejmech.2019.04.047
BindingDB Entry DOI: 10.7270/Q21V5J8N
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Dual specificity protein kinase TTK


(Homo sapiens (Human))		BDBM50386816
PNG
(CHEMBL2047943)
Show SMILES Cc1cc(ccc1Nc1nc(NC2CCCCC2)c2[nH]cnc2n1)N1CCOCC1
Show InChI InChI=1S/C22H29N7O/c1-15-13-17(29-9-11-30-12-10-29)7-8-18(15)26-22-27-20-19(23-14-24-20)21(28-22)25-16-5-3-2-4-6-16/h7-8,13-14,16H,2-6,9-12H2,1H3,(H3,23,24,25,26,27,28)
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n/an/a 1.80n/an/an/an/an/an/a



Jilin University

Curated by ChEMBL


Assay Description
Inhibition of MPS1 (519 to 808 residues) (unknown origin) expressed in Escherichia coli BL21(DE3) after 18 hrs

Eur J Med Chem 175: 247-268 (2019)


Article DOI: 10.1016/j.ejmech.2019.04.047
BindingDB Entry DOI: 10.7270/Q21V5J8N
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Dual specificity protein kinase TTK


(Homo sapiens (Human))		BDBM50512458
PNG
(CHEMBL4450240)
Show SMILES Cc1nc(ccc1Nc1nc(NC2CCOCC2)c2c(c[nH]c2n1)C#N)N1CCOCC1
Show InChI InChI=1S/C22H26N8O2/c1-14-17(2-3-18(25-14)30-6-10-32-11-7-30)27-22-28-20-19(15(12-23)13-24-20)21(29-22)26-16-4-8-31-9-5-16/h2-3,13,16H,4-11H2,1H3,(H3,24,26,27,28,29)
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n/an/a 2.5n/an/an/an/an/an/a



Jilin University

Curated by ChEMBL


Assay Description
Inhibition of MPS1 (510 to 857 residues) catalytic domain (unknown origin) expressed in Escherichia coli after 15 mins by mass-spectrometry analysis

Eur J Med Chem 175: 247-268 (2019)


Article DOI: 10.1016/j.ejmech.2019.04.047
BindingDB Entry DOI: 10.7270/Q21V5J8N
More data for this
Ligand-Target Pair
Dual specificity protein kinase TTK


(Homo sapiens (Human))		BDBM50072900
PNG
(CHEMBL3410073)
Show SMILES Nc1cc(ccc1-c1cc(NCC2CCOCC2)c2ncc(-c3ccc(cc3)C(=O)NC3CC3)n2n1)C#N
Show InChI InChI=1S/C29H29N7O2/c30-15-19-1-8-23(24(31)13-19)25-14-26(32-16-18-9-11-38-12-10-18)28-33-17-27(36(28)35-25)20-2-4-21(5-3-20)29(37)34-22-6-7-22/h1-5,8,13-14,17-18,22,32H,6-7,9-12,16,31H2,(H,34,37)
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n/an/a 2.5n/an/an/an/an/an/a



Jilin University

Curated by ChEMBL


Assay Description
Inhibition of MPS1 (unknown origin) using biotin-AhxPWDPDDADITEILG-NH2 as substrate preincubated for 15 mins followed by substrate addition by TR-FRE...

Eur J Med Chem 175: 247-268 (2019)


Article DOI: 10.1016/j.ejmech.2019.04.047
BindingDB Entry DOI: 10.7270/Q21V5J8N
More data for this
Ligand-Target Pair
Dual specificity protein kinase TTK


(Homo sapiens (Human))		BDBM50072911
PNG
(CHEMBL3410084)
Show SMILES CC(C)(Nc1cc(NCC2CCOCC2)c2ncc(-c3ccc(cc3)C(=O)NC3CC3)n2n1)C(F)(F)F
Show InChI InChI=1S/C26H31F3N6O2/c1-25(2,26(27,28)29)33-22-13-20(30-14-16-9-11-37-12-10-16)23-31-15-21(35(23)34-22)17-3-5-18(6-4-17)24(36)32-19-7-8-19/h3-6,13,15-16,19,30H,7-12,14H2,1-2H3,(H,32,36)(H,33,34)
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n/an/a 2.80n/an/an/an/an/an/a



Jilin University

Curated by ChEMBL


Assay Description
Inhibition of MPS1 (unknown origin) using biotin-AhxPWDPDDADITEILG-NH2 as substrate preincubated for 15 mins followed by substrate addition by TR-FRE...

Eur J Med Chem 175: 247-268 (2019)


Article DOI: 10.1016/j.ejmech.2019.04.047
BindingDB Entry DOI: 10.7270/Q21V5J8N
More data for this
Ligand-Target Pair
Dual specificity protein kinase TTK


(Homo sapiens (Human))		BDBM50512455
PNG
(CHEMBL4436510)
Show SMILES Cc1nc(ccc1Nc1nc(NC(C)(C)CO)c2c(c[nH]c2n1)C#N)N1CCOCC1
Show InChI InChI=1S/C21H26N8O2/c1-13-15(4-5-16(24-13)29-6-8-31-9-7-29)25-20-26-18-17(14(10-22)11-23-18)19(27-20)28-21(2,3)12-30/h4-5,11,30H,6-9,12H2,1-3H3,(H3,23,25,26,27,28)
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n/an/a 5.5n/an/an/an/an/an/a



Jilin University

Curated by ChEMBL


Assay Description
Inhibition of MPS1 (510 to 857 residues) catalytic domain (unknown origin) expressed in Escherichia coli after 15 mins by mass-spectrometry analysis

Eur J Med Chem 175: 247-268 (2019)


Article DOI: 10.1016/j.ejmech.2019.04.047
BindingDB Entry DOI: 10.7270/Q21V5J8N
More data for this
Ligand-Target Pair
Dual specificity protein kinase TTK


(Homo sapiens (Human))		BDBM50420401
PNG
(CHEMBL2089255 | US11208696, Example 31)
Show SMILES CC(C)(C)Nc1nc(Nc2ccc(cc2)C(N)=O)cc(N)c1C#N
Show InChI InChI=1S/C17H20N6O/c1-17(2,3)23-16-12(9-18)13(19)8-14(22-16)21-11-6-4-10(5-7-11)15(20)24/h4-8H,1-3H3,(H2,20,24)(H4,19,21,22,23)
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n/an/a 6.40n/an/an/an/an/an/a



Jilin University

Curated by ChEMBL


Assay Description
Inhibition of MPS1 (unknown origin)

Eur J Med Chem 175: 247-268 (2019)


Article DOI: 10.1016/j.ejmech.2019.04.047
BindingDB Entry DOI: 10.7270/Q21V5J8N
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Dual specificity protein kinase TTK


(Homo sapiens (Human))		BDBM50081539
PNG
(CHEMBL3422104)
Show SMILES CC(C)CNc1nc(cn2c(cnc12)-c1ccc(cc1)C(=O)NC1CC1)-c1cccc2ncccc12
Show InChI InChI=1S/C29H28N6O/c1-18(2)15-31-27-28-32-16-26(19-8-10-20(11-9-19)29(36)33-21-12-13-21)35(28)17-25(34-27)23-5-3-7-24-22(23)6-4-14-30-24/h3-11,14,16-18,21H,12-13,15H2,1-2H3,(H,31,34)(H,33,36)
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n/an/a 9n/an/an/an/an/an/a



Jilin University

Curated by ChEMBL


Assay Description
Inhibition of MPS1 (unknown origin)

Eur J Med Chem 175: 247-268 (2019)


Article DOI: 10.1016/j.ejmech.2019.04.047
BindingDB Entry DOI: 10.7270/Q21V5J8N
More data for this
Ligand-Target Pair
Dual specificity protein kinase TTK


(Homo sapiens (Human))		BDBM241235
PNG
(US10479788, Example 77 | US11046688, Example 77 | ...)
Show SMILES COc1cc(ccc1Nc1ncc2ccnc(N[C@@H](C)C(C)(C)C)c2n1)-c1cnn(C)c1 |r|
Show InChI InChI=1S/C24H29N7O/c1-15(24(2,3)4)28-22-21-17(9-10-25-22)12-26-23(30-21)29-19-8-7-16(11-20(19)32-6)18-13-27-31(5)14-18/h7-15H,1-6H3,(H,25,28)(H,26,29,30)/t15-/m0/s1
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n/an/a 11n/an/an/an/an/an/a



Jilin University

Curated by ChEMBL


Assay Description
Inhibition of MPS1 (unknown origin) in presence of 10 uM ATP

Eur J Med Chem 175: 247-268 (2019)


Article DOI: 10.1016/j.ejmech.2019.04.047
BindingDB Entry DOI: 10.7270/Q21V5J8N
More data for this
Ligand-Target Pair
Dual specificity protein kinase TTK


(Homo sapiens (Human))		BDBM241235
PNG
(US10479788, Example 77 | US11046688, Example 77 | ...)
Show SMILES COc1cc(ccc1Nc1ncc2ccnc(N[C@@H](C)C(C)(C)C)c2n1)-c1cnn(C)c1 |r|
Show InChI InChI=1S/C24H29N7O/c1-15(24(2,3)4)28-22-21-17(9-10-25-22)12-26-23(30-21)29-19-8-7-16(11-20(19)32-6)18-13-27-31(5)14-18/h7-15H,1-6H3,(H,25,28)(H,26,29,30)/t15-/m0/s1
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n/an/a 20n/an/an/an/an/an/a



Jilin University

Curated by ChEMBL


Assay Description
Inhibition of MPS1 (unknown origin) in presence of 1 mM ATP

Eur J Med Chem 175: 247-268 (2019)


Article DOI: 10.1016/j.ejmech.2019.04.047
BindingDB Entry DOI: 10.7270/Q21V5J8N
More data for this
Ligand-Target Pair
Dual specificity protein kinase TTK


(Homo sapiens (Human))		BDBM50446445
PNG
(CHEMBL2140523)
Show SMILES COc1cc(OC2CCN(C)CC2)ccc1Nc1ncc2n(C)c(=O)n(C3CCCC3)c2n1
Show InChI InChI=1S/C24H32N6O3/c1-28-12-10-17(11-13-28)33-18-8-9-19(21(14-18)32-3)26-23-25-15-20-22(27-23)30(24(31)29(20)2)16-6-4-5-7-16/h8-9,14-17H,4-7,10-13H2,1-3H3,(H,25,26,27)
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n/an/a 35n/an/an/an/an/an/a



Jilin University

Curated by ChEMBL


Assay Description
Inhibition of N-terminal GST-tagged full-length human Mps1 expressed in insect cells using FITC-DHTGFLTEYVATR-CONH2 as substrate after 25 mins by flu...

Eur J Med Chem 175: 247-268 (2019)


Article DOI: 10.1016/j.ejmech.2019.04.047
BindingDB Entry DOI: 10.7270/Q21V5J8N
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Dual specificity protein kinase TTK


(Homo sapiens (Human))		BDBM50512457
PNG
(CHEMBL4474534)
Show SMILES COc1cc(ccc1Nc1nc(Nc2ccccc2S(=O)(=O)C(C)C)c2nc[nH]c2n1)N1CCC(O)CC1
Show InChI InChI=1S/C26H31N7O4S/c1-16(2)38(35,36)22-7-5-4-6-20(22)29-25-23-24(28-15-27-23)31-26(32-25)30-19-9-8-17(14-21(19)37-3)33-12-10-18(34)11-13-33/h4-9,14-16,18,34H,10-13H2,1-3H3,(H3,27,28,29,30,31,32)
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Jilin University

Curated by ChEMBL


Assay Description
Inhibition of glioblastoma patient derived MPS1

Eur J Med Chem 175: 247-268 (2019)


Article DOI: 10.1016/j.ejmech.2019.04.047
BindingDB Entry DOI: 10.7270/Q21V5J8N
More data for this
Ligand-Target Pair
Dual specificity protein kinase TTK


(Homo sapiens (Human))		BDBM16018
PNG
(14,15-diazatetracyclo[7.6.1.0^{2,7}.0^{13,16}]hexa...)
Show SMILES O=C1c2ccccc2-c2n[nH]c3cccc1c23
Show InChI InChI=1S/C14H8N2O/c17-14-9-5-2-1-4-8(9)13-12-10(14)6-3-7-11(12)15-16-13/h1-7H,(H,15,16)
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n/an/a 98n/an/an/an/an/an/a



Jilin University

Curated by ChEMBL


Assay Description
Inhibition of MPS1 (unknown origin)

Eur J Med Chem 175: 247-268 (2019)


Article DOI: 10.1016/j.ejmech.2019.04.047
BindingDB Entry DOI: 10.7270/Q21V5J8N
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Dual specificity protein kinase TTK


(Homo sapiens (Human))		BDBM50349102
PNG
(CHEMBL1236095 | US11208696, Example 3)
Show SMILES CCc1cccc(CC)c1NC(=O)c1nn(C)c-2c1CCc1cnc(Nc3ccc(cc3OC(F)(F)F)C(=O)NC3CCN(C)CC3)nc-21
Show InChI InChI=1S/C35H39F3N8O3/c1-5-20-8-7-9-21(6-2)28(20)42-33(48)30-25-12-10-23-19-39-34(43-29(23)31(25)46(4)44-30)41-26-13-11-22(18-27(26)49-35(36,37)38)32(47)40-24-14-16-45(3)17-15-24/h7-9,11,13,18-19,24H,5-6,10,12,14-17H2,1-4H3,(H,40,47)(H,42,48)(H,39,41,43)
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n/an/a 182n/an/an/an/an/an/a



Jilin University

Curated by ChEMBL


Assay Description
Inhibition of MPS1 (unknown origin)

Eur J Med Chem 175: 247-268 (2019)


Article DOI: 10.1016/j.ejmech.2019.04.047
BindingDB Entry DOI: 10.7270/Q21V5J8N
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
* indicates data uncertainty>20%