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Compile Data Set for Download or QSAR

Found 2025 hits with Last Name = 'xing' and Initial = 'x'   
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
Ubiquitin carboxyl-terminal hydrolase isozyme L1


(Mus musculus (Mouse))		BDBM53441
PNG
(MLS001000876 | N-(1H-benzimidazol-2-yl)-3-chlorany...)
Show SMILES Clc1cccc(c1)C(=O)Nc1nc2ccccc2[nH]1
Show InChI InChI=1S/C14H10ClN3O/c15-10-5-3-4-9(8-10)13(19)18-14-16-11-6-1-2-7-12(11)17-14/h1-8H,(H2,16,17,18,19)
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 400 -36.5 880n/an/an/an/a7.625



Brigham and Women's Hospital



Assay Description
Inhibition activity and selectivity for UCH-L1 and UCH-L3.

Chem Biol 10: 837-46 (2003)


Article DOI: 10.1016/j.chembiol.2003.08.010
BindingDB Entry DOI: 10.7270/Q20Z71P9
More data for this
Ligand-Target Pair
Activin receptor type-1


(Mus musculus)		BDBM50262079
PNG
(4-(6-(4-(piperazin-1-yl)phenyl)pyrazolo[1,5-a]pyri...)
Show SMILES C1CN(CCN1)c1ccc(cc1)-c1cnc2c(cnn2c1)-c1ccnc2ccccc12
Show InChI InChI=1S/C25H22N6/c1-2-4-24-22(3-1)21(9-10-27-24)23-16-29-31-17-19(15-28-25(23)31)18-5-7-20(8-6-18)30-13-11-26-12-14-30/h1-10,15-17,26H,11-14H2
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n/an/a 0.670n/an/an/an/an/an/a



Massachusetts Institute of Technology





ACS Chem Biol 8: 1291-302 (2013)


Article DOI: 10.1021/cb300655w
BindingDB Entry DOI: 10.7270/Q2ZW1JKW
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Serine/threonine-protein kinase PLK1


(Homo sapiens (Human))		BDBM50435727
PNG
(CHEMBL2392545)
Show SMILES COc1cc(C(=O)NC2CCN(C)CC2)c(F)cc1Nc1ncc2N(C)C(=O)C(F)(F)CN(C3CCCC3)c2n1
Show InChI InChI=1S/C27H34F3N7O3/c1-35-10-8-16(9-11-35)32-24(38)18-12-22(40-3)20(13-19(18)28)33-26-31-14-21-23(34-26)37(17-6-4-5-7-17)15-27(29,30)25(39)36(21)2/h12-14,16-17H,4-11,15H2,1-3H3,(H,32,38)(H,31,33,34)
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n/an/a 0.800n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113314
BindingDB Entry DOI: 10.7270/Q2X63RWZ
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Serine/threonine-protein kinase PLK1


(Homo sapiens (Human))		BDBM25121
PNG
(4-{[(7R)-8-cyclopentyl-7-ethyl-5-methyl-6-oxo-5,6,...)
Show SMILES CC[C@H]1N(C2CCCC2)c2nc(Nc3ccc(cc3OC)C(=O)NC3CCN(C)CC3)ncc2N(C)C1=O |r|
Show InChI InChI=1S/C28H39N7O3/c1-5-22-27(37)34(3)23-17-29-28(32-25(23)35(22)20-8-6-7-9-20)31-21-11-10-18(16-24(21)38-4)26(36)30-19-12-14-33(2)15-13-19/h10-11,16-17,19-20,22H,5-9,12-15H2,1-4H3,(H,30,36)(H,29,31,32)/t22-/m1/s1
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n/an/a 0.830n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113314
BindingDB Entry DOI: 10.7270/Q2X63RWZ
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM497489
PNG
(US11008304, Example 75)
Show SMILES COc1cc(C)c(cc1C(=O)Nc1cccc(n1)-c1nnnn1C(C)C)-c1cnn(c1)C1CC1
Show InChI InChI=1S/C24H26N8O2/c1-14(2)32-23(28-29-30-32)20-6-5-7-22(26-20)27-24(33)19-11-18(15(3)10-21(19)34-4)16-12-25-31(13-16)17-8-9-17/h5-7,10-14,17H,8-9H2,1-4H3,(H,26,27,33)
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n/an/a<1n/an/an/an/an/an/a



Enanta Pharmaceuticals, Inc.

US Patent


Assay Description
The ability (IC50) of compounds to inhibit ASK1 kinase activity was determined by HTRF® KinEASE™ Assay System. ASK1 was purchased from Thermofisher (...

US Patent US11008304 (2021)


BindingDB Entry DOI: 10.7270/Q2D50R3H
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM497490
PNG
(US11008304, Example 76)
Show SMILES COc1cc(C)c(cc1C(=O)Nc1cccc(n1)-n1nnnc1C(C)C)-c1cnn(c1)C1CC1
Show InChI InChI=1S/C24H26N8O2/c1-14(2)23-28-29-30-32(23)22-7-5-6-21(26-22)27-24(33)19-11-18(15(3)10-20(19)34-4)16-12-25-31(13-16)17-8-9-17/h5-7,10-14,17H,8-9H2,1-4H3,(H,26,27,33)
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Enanta Pharmaceuticals, Inc.

US Patent


Assay Description
The ability (IC50) of compounds to inhibit ASK1 kinase activity was determined by HTRF® KinEASE™ Assay System. ASK1 was purchased from Thermofisher (...

US Patent US11008304 (2021)


BindingDB Entry DOI: 10.7270/Q2D50R3H
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM497491
PNG
(US11008304, Example 77)
Show SMILES COc1cc(C)c(cc1C(=O)Nc1cccc(n1)-c1nnnn1[C@H](C)CO)-c1cnn(c1)C1CC1 |r|
Show InChI InChI=1S/C24H26N8O3/c1-14-9-21(35-3)19(10-18(14)16-11-25-31(12-16)17-7-8-17)24(34)27-22-6-4-5-20(26-22)23-28-29-30-32(23)15(2)13-33/h4-6,9-12,15,17,33H,7-8,13H2,1-3H3,(H,26,27,34)/t15-/m1/s1
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Enanta Pharmaceuticals, Inc.

US Patent


Assay Description
The ability (IC50) of compounds to inhibit ASK1 kinase activity was determined by HTRF® KinEASE™ Assay System. ASK1 was purchased from Thermofisher (...

US Patent US11008304 (2021)


BindingDB Entry DOI: 10.7270/Q2D50R3H
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM497494
PNG
(US11008304, Example 80)
Show SMILES COc1cc(C)c(cc1C(=O)Nc1cccc(n1)-c1nnnn1[C@H](C)CO)-c1ccn(n1)C(C)C |r|
Show InChI InChI=1S/C24H28N8O3/c1-14(2)31-10-9-19(28-31)17-12-18(21(35-5)11-15(17)3)24(34)26-22-8-6-7-20(25-22)23-27-29-30-32(23)16(4)13-33/h6-12,14,16,33H,13H2,1-5H3,(H,25,26,34)/t16-/m1/s1
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Enanta Pharmaceuticals, Inc.

US Patent


Assay Description
The ability (IC50) of compounds to inhibit ASK1 kinase activity was determined by HTRF® KinEASE™ Assay System. ASK1 was purchased from Thermofisher (...

US Patent US11008304 (2021)


BindingDB Entry DOI: 10.7270/Q2D50R3H
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM445429
PNG
(US10683279, Example 26a | US10988458, Example 26a ...)
Show SMILES Cc1cc(F)c(cc1-n1cnc(c1)C1CC1)C(=O)Nc1cccc(n1)-c1nnnn1C(CO)CO
Show InChI InChI=1S/C23H23FN8O3/c1-13-7-17(24)16(8-20(13)31-9-19(25-12-31)14-5-6-14)23(35)27-21-4-2-3-18(26-21)22-28-29-30-32(22)15(10-33)11-34/h2-4,7-9,12,14-15,33-34H,5-6,10-11H2,1H3,(H,26,27,35)
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n/an/a<1n/an/an/an/an/an/a


TBA

Assay Description
ASK1 was purchased from Thermofisher (Catalogue # PV4011), ATP was purchased from Sigma (Catalogue # A7699), HTRF® KinEASE™ Assay System was obtained...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2WM1JBC
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM445429
PNG
(US10683279, Example 26a | US10988458, Example 26a ...)
Show SMILES Cc1cc(F)c(cc1-n1cnc(c1)C1CC1)C(=O)Nc1cccc(n1)-c1nnnn1C(CO)CO
Show InChI InChI=1S/C23H23FN8O3/c1-13-7-17(24)16(8-20(13)31-9-19(25-12-31)14-5-6-14)23(35)27-21-4-2-3-18(26-21)22-28-29-30-32(22)15(10-33)11-34/h2-4,7-9,12,14-15,33-34H,5-6,10-11H2,1H3,(H,26,27,35)
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Enanta Pharmaceuticals, Inc.

US Patent


Assay Description
ASK1 was purchased from Thermofisher, ATP was purchased from Sigma , HTRF® KinEASE™ Assay System was obtained from Cisbio (Bedford, Mass). ½ Area pla...

US Patent US10683279 (2020)


BindingDB Entry DOI: 10.7270/Q2JQ1436
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM419047
PNG
(US10450301, Example 126)
Show SMILES C[C@H](CO)n1nnnc1-c1cccc(NC(=O)c2cc3CN(CCc3cn2)C(=O)OCC(F)(F)F)n1 |r|
Show InChI InChI=1S/C21H21F3N8O4/c1-12(10-33)32-18(28-29-30-32)15-3-2-4-17(26-15)27-19(34)16-7-14-9-31(6-5-13(14)8-25-16)20(35)36-11-21(22,23)24/h2-4,7-8,12,33H,5-6,9-11H2,1H3,(H,26,27,34)/t12-/m1/s1
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n/an/a<1n/an/an/an/an/an/a



Enanta Pharmaceuticals, Inc.

US Patent


Assay Description
HTRF KinEASE-STK is a generic method for measuring serine/threonine kinase activities using a time-resolved fluorescence resonance energy transfer (T...

US Patent US10450301 (2019)


BindingDB Entry DOI: 10.7270/Q2P84F7M
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM419108
PNG
(US10450301, Example 187)
Show SMILES CCn1cc(CNC(=O)N2CCc3cnc(cc3C2)C(=O)Nc2cccc(n2)-c2nnnn2[C@H](C)CO)cn1 |r|
Show InChI InChI=1S/C25H29N11O3/c1-3-35-13-17(11-28-35)10-27-25(39)34-8-7-18-12-26-21(9-19(18)14-34)24(38)30-22-6-4-5-20(29-22)23-31-32-33-36(23)16(2)15-37/h4-6,9,11-13,16,37H,3,7-8,10,14-15H2,1-2H3,(H,27,39)(H,29,30,38)/t16-/m1/s1
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Enanta Pharmaceuticals, Inc.

US Patent


Assay Description
HTRF KinEASE-STK is a generic method for measuring serine/threonine kinase activities using a time-resolved fluorescence resonance energy transfer (T...

US Patent US10450301 (2019)


BindingDB Entry DOI: 10.7270/Q2P84F7M
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM445429
PNG
(US10683279, Example 26a | US10988458, Example 26a ...)
Show SMILES Cc1cc(F)c(cc1-n1cnc(c1)C1CC1)C(=O)Nc1cccc(n1)-c1nnnn1C(CO)CO
Show InChI InChI=1S/C23H23FN8O3/c1-13-7-17(24)16(8-20(13)31-9-19(25-12-31)14-5-6-14)23(35)27-21-4-2-3-18(26-21)22-28-29-30-32(22)15(10-33)11-34/h2-4,7-9,12,14-15,33-34H,5-6,10-11H2,1H3,(H,26,27,35)
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Enanta Pharmaceuticals, Inc.

US Patent


Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE™ Assay System was obtained f...

US Patent US10988458 (2021)


BindingDB Entry DOI: 10.7270/Q2320007
More data for this
Ligand-Target Pair
Activin receptor type-1


(Mus musculus)		BDBM102619
PNG
(K02288a | US10688093, Compound 382_0087_0284 | US1...)
Show SMILES COc1cc(cc(OC)c1OC)-c1cc(cnc1N)-c1cccc(O)c1
Show InChI InChI=1S/C20H20N2O4/c1-24-17-9-13(10-18(25-2)19(17)26-3)16-8-14(11-22-20(16)21)12-5-4-6-15(23)7-12/h4-11,23H,1-3H3,(H2,21,22)
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n/an/a 1.20n/an/an/an/an/an/a



Massachusetts Institute of Technology





ACS Chem Biol 8: 1291-302 (2013)


Article DOI: 10.1021/cb300655w
BindingDB Entry DOI: 10.7270/Q2ZW1JKW
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556244
PNG
(US11345699, Example 127)
Show SMILES COc1cc2CCN(Cc2cc1C(=O)Nc1cccc(n1)-c1nncn1C(C)C)C(=O)C[C@H](C)O |r|
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n/an/a<1.25n/an/an/an/an/an/a


TBA

Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556244
PNG
(US11345699, Example 127)
Show SMILES COc1cc2CCN(Cc2cc1C(=O)Nc1cccc(n1)-c1nncn1C(C)C)C(=O)C[C@H](C)O |r|
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TBA

Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556245
PNG
(US11345699, Example 128)
Show SMILES COc1cc2CCN(Cc2cc1C(=O)Nc1cccc(n1)-c1nncn1C(C)C)C(=O)[C@@H](O)CC(C)C |r|
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TBA

Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556245
PNG
(US11345699, Example 128)
Show SMILES COc1cc2CCN(Cc2cc1C(=O)Nc1cccc(n1)-c1nncn1C(C)C)C(=O)[C@@H](O)CC(C)C |r|
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TBA

Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556246
PNG
(US11345699, Example 129)
Show SMILES COc1cc2CCN(Cc2cc1C(=O)Nc1cccc(n1)-c1nncn1C(C)C)C(=O)C(C)(C)O
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TBA

Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556246
PNG
(US11345699, Example 129)
Show SMILES COc1cc2CCN(Cc2cc1C(=O)Nc1cccc(n1)-c1nncn1C(C)C)C(=O)C(C)(C)O
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TBA

Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556247
PNG
(US11345699, Example 130)
Show SMILES COc1cc2CCN(Cc2cc1C(=O)Nc1cccc(n1)-c1nnnn1[C@H](C)CO)C(=O)OCC(C)(C)O |r|
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TBA

Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556247
PNG
(US11345699, Example 130)
Show SMILES COc1cc2CCN(Cc2cc1C(=O)Nc1cccc(n1)-c1nnnn1[C@H](C)CO)C(=O)OCC(C)(C)O |r|
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Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556248
PNG
(US11345699, Example 131)
Show SMILES COc1cc2CCN(Cc2cc1C(=O)Nc1cccc(n1)-c1nnnn1[C@H](C)CO)C(=O)C1CCOCC1 |r|
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Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556248
PNG
(US11345699, Example 131)
Show SMILES COc1cc2CCN(Cc2cc1C(=O)Nc1cccc(n1)-c1nnnn1[C@H](C)CO)C(=O)C1CCOCC1 |r|
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Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556249
PNG
(US11345699, Example 132)
Show SMILES COc1cc2CCN(CC(=O)N3CCCC3)Cc2cc1C(=O)Nc1cccc(n1)-c1nnnn1[C@H](C)CO |r|
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Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556249
PNG
(US11345699, Example 132)
Show SMILES COc1cc2CCN(CC(=O)N3CCCC3)Cc2cc1C(=O)Nc1cccc(n1)-c1nnnn1[C@H](C)CO |r|
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Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556258
PNG
(US11345699, Example 141)
Show SMILES COc1cc2CCN(Cc2cc1C(=O)Nc1cccc(n1)-c1nnnn1[C@H](C)CO)C(=O)OC[C@@H](O)C(F)(F)F |r|
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Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556258
PNG
(US11345699, Example 141)
Show SMILES COc1cc2CCN(Cc2cc1C(=O)Nc1cccc(n1)-c1nnnn1[C@H](C)CO)C(=O)OC[C@@H](O)C(F)(F)F |r|
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Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556259
PNG
(US11345699, Example 142)
Show SMILES COc1cc2CCN(Cc2cc1C(=O)Nc1cccc(n1)-c1nnnn1[C@H](C)CO)C(=O)[C@@H]1CCOC1 |r|
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Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556259
PNG
(US11345699, Example 142)
Show SMILES COc1cc2CCN(Cc2cc1C(=O)Nc1cccc(n1)-c1nnnn1[C@H](C)CO)C(=O)[C@@H]1CCOC1 |r|
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Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556261
PNG
(US11345699, Example 144)
Show SMILES COc1cc2CCN(Cc2cc1C(=O)Nc1cccc(n1)-c1nnnn1[C@H](C)CO)C(=O)N1CC[C@@H](O)C1 |r|
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Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556186
PNG
(US11345699, Example 68)
Show SMILES C[C@H](CO)n1cnnc1-c1cccc(NC(=O)c2cc3CN(CCc3cc2F)C(=O)N2CCCC2)n1 |r|
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Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556187
PNG
(US11345699, Example 69)
Show SMILES CC(C)N1CCc2cc(F)c(cc2C1)C(=O)Nc1cccc(n1)-c1nncn1[C@H](C)CO |r|
PDB

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Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556188
PNG
(US11345699, Example 70)
Show SMILES CCNC(=O)N1CCc2cc(F)c(cc2C1)C(=O)Nc1cccc(n1)-c1nncn1[C@H](C)CO |r|
PDB

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Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556189
PNG
(US11345699, Example 71)
Show SMILES C[C@H](CO)n1cnnc1-c1cccc(NC(=O)c2cc3CN(CCc3cc2F)C(=O)NC2CCCC2)n1 |r|
PDB

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Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556190
PNG
(US11345699, Example 72)
Show SMILES COc1cc2CCN(Cc2cc1C(=O)Nc1cccc(n1)-c1nncn1[C@H](C)CO)S(=O)(=O)CCC(F)(F)F |r|
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Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556191
PNG
(US11345699, Example 73)
Show SMILES COc1cc2CCN(Cc2cc1C(=O)Nc1cccc(n1)-c1nncn1[C@H](C)CO)C(=O)C(C)(C)C |r|
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Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556192
PNG
(US11345699, Example 74)
Show SMILES COc1cc2CCN(Cc2cc1C(=O)Nc1cccc(n1)-c1nncn1[C@H](C)CO)C(=O)N1CCCC1 |r|
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Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556193
PNG
(US11345699, Example 75)
Show SMILES COc1cc2CCN(Cc2cc1C(=O)Nc1cccc(n1)-c1nncn1[C@H](C)CO)C(C)C |r|
PDB

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Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556194
PNG
(US11345699, Example 76)
Show SMILES COc1cc2CCN(Cc2cc1C(=O)Nc1cccc(n1)-c1nnnn1[C@H](C)CO)C(=O)OCc1ccccc1 |r|
PDB

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Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556195
PNG
(US11345699, Example 77)
Show SMILES COc1cc2CCN(Cc2cc1C(=O)Nc1cccc(n1)-c1nnnn1[C@H](C)CO)C(=O)OC(C)C |r|
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Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556196
PNG
(US11345699, Example 78)
Show SMILES COc1cc2CCN(Cc2cc1C(=O)Nc1cccc(n1)-c1nnnn1[C@H](C)CO)S(=O)(=O)C1CC1 |r|
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Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556197
PNG
(US11345699, Example 79)
Show SMILES COc1cc2CCN(Cc2cc1C(=O)Nc1cccc(n1)-c1nnnn1[C@H](C)CO)C(=O)c1ccc(F)cc1 |r|
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Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556206
PNG
(US11345699, Example 88)
Show SMILES COc1cc2CCN(Cc2cc1C(=O)Nc1cccc(n1)-c1nnnn1[C@H](C)CO)C(=O)C(C)(C)C |r|
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Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556207
PNG
(US11345699, Example 89)
Show SMILES COc1cc2CCN(Cc2cc1C(=O)Nc1cccc(n1)-c1nnnn1[C@H](C)CO)C(=O)N1CCCC1 |r|
PDB

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Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556208
PNG
(US11345699, Example 90)
Show SMILES COc1cc2CCN(Cc2cc1C(=O)Nc1cccc(n1)-c1nnnn1[C@H](C)CO)C(C)C |r|
PDB

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Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556209
PNG
(US11345699, Example 91)
Show SMILES COc1cc2CCN(Cc2cc1C(=O)Nc1cccc(n1)-c1nnnn1[C@H](C)CO)C(=O)C[C@H](C)O |r|
PDB

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Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556210
PNG
(US11345699, Example 92)
Show SMILES COc1cc2CCN(Cc2cc1C(=O)Nc1cccc(n1)-c1nnnn1[C@H](C)CO)C(=O)c1cnn(C)c1 |r|
PDB

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Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556211
PNG
(US11345699, Example 93 | US11345699, Example 96)
Show SMILES COCCOC(=O)N1CCc2cc(OC)c(cc2C1)C(=O)Nc1cccc(n1)-c1nnnn1[C@H](C)CO |r|
PDB

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Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 5


(Homo sapiens (Human))		BDBM556214
PNG
(US11345699, Example 97)
Show SMILES COc1cc2CCN(Cc2cc1C(=O)Nc1cccc(n1)-c1nnnn1[C@H](C)CO)C(=O)c1cnn(c1)C1CC1 |r|
PDB

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Assay Description
ASK1 was purchased from Thermofisher (Catalogue #PV4011), ATP was purchased from Sigma (Catalogue #A7699), HTRF® KinEASE Assay System was obtained fr...

Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077H5
More data for this
Ligand-Target Pair
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