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Compile Data Set for Download or QSAR

Found 54 hits of ph data with Target = 'Rho-associated protein kinase 1'   
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
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM14054
PNG
(N-(4-fluoro-1H-indazol-5-yl)-2-methyl-6-oxo-4-[4-(...)
Show SMILES CC1=C(C(CC(=O)N1)c1ccc(cc1)C(F)(F)F)C(=O)Nc1ccc2[nH]ncc2c1F
Show InChI InChI=1S/C21H16F4N4O2/c1-10-18(20(31)28-16-7-6-15-14(19(16)22)9-26-29-15)13(8-17(30)27-10)11-2-4-12(5-3-11)21(23,24)25/h2-7,9,13H,8H2,1H3,(H,26,29)(H,27,30)(H,28,31)
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n/an/a 2.50E+3n/an/an/an/a7.422



GlaxoSmithKline



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP/[gamma-33P] ATP, the subsequent incorporation of 33P into the peptid...


J Med Chem 50: 6-9 (2007)


Article DOI: 10.1021/jm0609014
BindingDB Entry DOI: 10.7270/Q298858V
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM25499
PNG
(4-(4-chloro-2-fluorophenyl)-2-(2-ethoxypyridin-4-y...)
Show SMILES CCOc1cc(ccn1)C1=NC(C)=C(C(N1)c1ccc(Cl)cc1F)C(=O)Nc1cc2cn[nH]c2cc1F
Show InChI InChI=1S/C26H21ClF2N6O2/c1-3-37-22-9-14(6-7-30-22)25-32-13(2)23(24(34-25)17-5-4-16(27)10-18(17)28)26(36)33-21-8-15-12-31-35-20(15)11-19(21)29/h4-12,24H,3H2,1-2H3,(H,31,35)(H,32,34)(H,33,36)
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n/an/a 11n/an/an/an/a7.422



GSK



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP33, and the incorporation of P33 into the peptide was quantified by Sc...


J Med Chem 51: 6631-4 (2008)


Article DOI: 10.1021/jm8005096
BindingDB Entry DOI: 10.7270/Q2F47MFZ
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM25498
PNG
(4-(4-chloro-2-fluorophenyl)-N-(6-fluoro-1H-indazol...)
Show SMILES COc1cc(ccn1)C1=NC(C)=C(C(N1)c1ccc(Cl)cc1F)C(=O)Nc1cc2cn[nH]c2cc1F
Show InChI InChI=1S/C25H19ClF2N6O2/c1-12-22(25(35)32-20-7-14-11-30-34-19(14)10-18(20)28)23(16-4-3-15(26)9-17(16)27)33-24(31-12)13-5-6-29-21(8-13)36-2/h3-11,23H,1-2H3,(H,30,34)(H,31,33)(H,32,35)
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n/an/a 6n/an/an/an/a7.422



GSK



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP33, and the incorporation of P33 into the peptide was quantified by Sc...


J Med Chem 51: 6631-4 (2008)


Article DOI: 10.1021/jm8005096
BindingDB Entry DOI: 10.7270/Q2F47MFZ
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM25497
PNG
(4-(4-chloro-2-fluorophenyl)-2-(2-chloropyridin-4-y...)
Show SMILES Cc1n[nH]c2ccc(NC(=O)C3=C(C)N=C(NC3c3ccc(Cl)cc3F)c3ccnc(Cl)c3)cc12
Show InChI InChI=1S/C25H19Cl2FN6O/c1-12-18-11-16(4-6-20(18)34-33-12)31-25(35)22-13(2)30-24(14-7-8-29-21(27)9-14)32-23(22)17-5-3-15(26)10-19(17)28/h3-11,23H,1-2H3,(H,30,32)(H,31,35)(H,33,34)
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n/an/a 15n/an/an/an/a7.422



GSK



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP33, and the incorporation of P33 into the peptide was quantified by Sc...


J Med Chem 51: 6631-4 (2008)


Article DOI: 10.1021/jm8005096
BindingDB Entry DOI: 10.7270/Q2F47MFZ
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM14032
PNG
(4-(1-ethyl-1H-imidazo[4,5-c]pyridin-2-yl)-1,2,5-ox...)
Show SMILES CCn1c(nc2cnccc12)-c1nonc1N
Show InChI InChI=1S/C10H10N6O/c1-2-16-7-3-4-12-5-6(7)13-10(16)8-9(11)15-17-14-8/h3-5H,2H2,1H3,(H2,11,15)
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n/an/a 19n/an/an/an/a7.422



GlaxoSmithKline



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP/[gamma-33P] ATP, the subsequent incorporation of 33P into the peptid...


J Med Chem 50: 2-5 (2007)


Article DOI: 10.1021/jm060873p
BindingDB Entry DOI: 10.7270/Q2F18WZB
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM14033
PNG
(4-{1-ethyl-6-methoxy-1H-imidazo[4,5-c]pyridin-2-yl...)
Show SMILES CCn1c(nc2cnc(OC)cc12)-c1nonc1N
Show InChI InChI=1S/C11H12N6O2/c1-3-17-7-4-8(18-2)13-5-6(7)14-11(17)9-10(12)16-19-15-9/h4-5H,3H2,1-2H3,(H2,12,16)
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n/an/a 4.40n/an/an/an/a7.422



GlaxoSmithKline



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP/[gamma-33P] ATP, the subsequent incorporation of 33P into the peptid...


J Med Chem 50: 2-5 (2007)


Article DOI: 10.1021/jm060873p
BindingDB Entry DOI: 10.7270/Q2F18WZB
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM14034
PNG
(4-{1-ethyl-6-phenoxy-1H-imidazo[4,5-c]pyridin-2-yl...)
Show SMILES CCn1c(nc2cnc(Oc3ccccc3)cc12)-c1nonc1N
Show InChI InChI=1S/C16H14N6O2/c1-2-22-12-8-13(23-10-6-4-3-5-7-10)18-9-11(12)19-16(22)14-15(17)21-24-20-14/h3-9H,2H2,1H3,(H2,17,21)
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n/an/a 30n/an/an/an/a7.422



GlaxoSmithKline



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP/[gamma-33P] ATP, the subsequent incorporation of 33P into the peptid...


J Med Chem 50: 2-5 (2007)


Article DOI: 10.1021/jm060873p
BindingDB Entry DOI: 10.7270/Q2F18WZB
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM14035
PNG
(Aminofurazanyl-azabenzimidazole 6c | N-(3-{[2-(4-a...)
Show SMILES CCn1c(nc2cnc(Oc3cccc(NC(C)=O)c3)cc12)-c1nonc1N
Show InChI InChI=1S/C18H17N7O3/c1-3-25-14-8-15(27-12-6-4-5-11(7-12)21-10(2)26)20-9-13(14)22-18(25)16-17(19)24-28-23-16/h4-9H,3H2,1-2H3,(H2,19,24)(H,21,26)
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n/an/a 1.80n/an/an/an/a7.422



GlaxoSmithKline



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP/[gamma-33P] ATP, the subsequent incorporation of 33P into the peptid...


J Med Chem 50: 2-5 (2007)


Article DOI: 10.1021/jm060873p
BindingDB Entry DOI: 10.7270/Q2F18WZB
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM14036
PNG
(Aminofurazanyl-azabenzimidazole 6d | N-(4-{[2-(4-a...)
Show SMILES CCn1c(nc2cnc(Oc3ccc(NC(C)=O)cc3)cc12)-c1nonc1N
Show InChI InChI=1S/C18H17N7O3/c1-3-25-14-8-15(27-12-6-4-11(5-7-12)21-10(2)26)20-9-13(14)22-18(25)16-17(19)24-28-23-16/h4-9H,3H2,1-2H3,(H2,19,24)(H,21,26)
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n/an/a 90n/an/an/an/a7.422



GlaxoSmithKline



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP/[gamma-33P] ATP, the subsequent incorporation of 33P into the peptid...


J Med Chem 50: 2-5 (2007)


Article DOI: 10.1021/jm060873p
BindingDB Entry DOI: 10.7270/Q2F18WZB
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM14037
PNG
(1-(3-{[2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-1H...)
Show SMILES CCn1c(nc2cnc(Oc3cccc(c3)C(C)=O)cc12)-c1nonc1N
Show InChI InChI=1S/C18H16N6O3/c1-3-24-14-8-15(26-12-6-4-5-11(7-12)10(2)25)20-9-13(14)21-18(24)16-17(19)23-27-22-16/h4-9H,3H2,1-2H3,(H2,19,23)
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n/an/a 13n/an/an/an/a7.422



GlaxoSmithKline



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP/[gamma-33P] ATP, the subsequent incorporation of 33P into the peptid...


J Med Chem 50: 2-5 (2007)


Article DOI: 10.1021/jm060873p
BindingDB Entry DOI: 10.7270/Q2F18WZB
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM14038
PNG
(4-[1-ethyl-6-(3-methanesulfonylphenoxy)-1H-imidazo...)
Show SMILES CCn1c(nc2cnc(Oc3cccc(c3)S(C)(=O)=O)cc12)-c1nonc1N
Show InChI InChI=1S/C17H16N6O4S/c1-3-23-13-8-14(26-10-5-4-6-11(7-10)28(2,24)25)19-9-12(13)20-17(23)15-16(18)22-27-21-15/h4-9H,3H2,1-2H3,(H2,18,22)
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n/an/a 33n/an/an/an/a7.422



GlaxoSmithKline



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP/[gamma-33P] ATP, the subsequent incorporation of 33P into the peptid...


J Med Chem 50: 2-5 (2007)


Article DOI: 10.1021/jm060873p
BindingDB Entry DOI: 10.7270/Q2F18WZB
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM14039
PNG
(4-[6-(3-aminophenoxy)-1-ethyl-1H-imidazo[4,5-c]pyr...)
Show SMILES CCn1c(nc2cnc(Oc3cccc(N)c3)cc12)-c1nonc1N
Show InChI InChI=1S/C16H15N7O2/c1-2-23-12-7-13(24-10-5-3-4-9(17)6-10)19-8-11(12)20-16(23)14-15(18)22-25-21-14/h3-8H,2,17H2,1H3,(H2,18,22)
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n/an/a 18n/an/an/an/a7.422



GlaxoSmithKline



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP/[gamma-33P] ATP, the subsequent incorporation of 33P into the peptid...


J Med Chem 50: 2-5 (2007)


Article DOI: 10.1021/jm060873p
BindingDB Entry DOI: 10.7270/Q2F18WZB
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM14040
PNG
(Aminofurazanyl-azabenzimidazole 6g | N-(3-{[2-(4-a...)
Show SMILES CCn1c(nc2cnc(Oc3cccc(NC(=O)c4ccccc4)c3)cc12)-c1nonc1N
Show InChI InChI=1S/C23H19N7O3/c1-2-30-18-12-19(25-13-17(18)27-22(30)20-21(24)29-33-28-20)32-16-10-6-9-15(11-16)26-23(31)14-7-4-3-5-8-14/h3-13H,2H2,1H3,(H2,24,29)(H,26,31)
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n/an/a 4n/an/an/an/a7.422



GlaxoSmithKline



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP/[gamma-33P] ATP, the subsequent incorporation of 33P into the peptid...


J Med Chem 50: 2-5 (2007)


Article DOI: 10.1021/jm060873p
BindingDB Entry DOI: 10.7270/Q2F18WZB
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM14041
PNG
(Aminofurazanyl-azabenzimidazole 6h | N-(3-{[2-(4-a...)
Show SMILES CCn1c(nc2cnc(Oc3cccc(NC(=O)c4ccc(cc4)N(C)C)c3)cc12)-c1nonc1N
Show InChI InChI=1S/C25H24N8O3/c1-4-33-20-13-21(27-14-19(20)29-24(33)22-23(26)31-36-30-22)35-18-7-5-6-16(12-18)28-25(34)15-8-10-17(11-9-15)32(2)3/h5-14H,4H2,1-3H3,(H2,26,31)(H,28,34)
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n/an/a 2n/an/an/an/a7.422



GlaxoSmithKline



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP/[gamma-33P] ATP, the subsequent incorporation of 33P into the peptid...


J Med Chem 50: 2-5 (2007)


Article DOI: 10.1021/jm060873p
BindingDB Entry DOI: 10.7270/Q2F18WZB
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM14042
PNG
(Aminofurazanyl-azabenzimidazole 6i | N-(3-{[2-(4-a...)
Show SMILES CCn1c(nc2cnc(Oc3cccc(NC(=O)c4ccc(cc4)N4CCOCC4)c3)cc12)-c1nonc1N
Show InChI InChI=1S/C27H26N8O4/c1-2-35-22-15-23(29-16-21(22)31-26(35)24-25(28)33-39-32-24)38-20-5-3-4-18(14-20)30-27(36)17-6-8-19(9-7-17)34-10-12-37-13-11-34/h3-9,14-16H,2,10-13H2,1H3,(H2,28,33)(H,30,36)
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n/an/a<1n/an/an/an/a7.422



GlaxoSmithKline



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP/[gamma-33P] ATP, the subsequent incorporation of 33P into the peptid...


J Med Chem 50: 2-5 (2007)


Article DOI: 10.1021/jm060873p
BindingDB Entry DOI: 10.7270/Q2F18WZB
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM14043
PNG
(Aminofurazanyl-azabenzimidazole 6j | N-(3-{[2-(4-a...)
Show SMILES CCn1c(nc2cnc(Oc3cccc(NC(=O)c4ccc(CN)cc4)c3)cc12)-c1nonc1N
Show InChI InChI=1S/C24H22N8O3/c1-2-32-19-11-20(27-13-18(19)29-23(32)21-22(26)31-35-30-21)34-17-5-3-4-16(10-17)28-24(33)15-8-6-14(12-25)7-9-15/h3-11,13H,2,12,25H2,1H3,(H2,26,31)(H,28,33)
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n/an/a<1n/an/an/an/a7.422



GlaxoSmithKline



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP/[gamma-33P] ATP, the subsequent incorporation of 33P into the peptid...


J Med Chem 50: 2-5 (2007)


Article DOI: 10.1021/jm060873p
BindingDB Entry DOI: 10.7270/Q2F18WZB
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM14044
PNG
(Aminofurazanyl-azabenzimidazole 6k | N-(3-{[2-(4-a...)
Show SMILES CCn1c(nc2cnc(Oc3cccc(NC(=O)c4ccc(CN(C)C)cc4)c3)cc12)-c1nonc1N
Show InChI InChI=1S/C26H26N8O3/c1-4-34-21-13-22(28-14-20(21)30-25(34)23-24(27)32-37-31-23)36-19-7-5-6-18(12-19)29-26(35)17-10-8-16(9-11-17)15-33(2)3/h5-14H,4,15H2,1-3H3,(H2,27,32)(H,29,35)
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n/an/a<1n/an/an/an/a7.422



GlaxoSmithKline



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP/[gamma-33P] ATP, the subsequent incorporation of 33P into the peptid...


J Med Chem 50: 2-5 (2007)


Article DOI: 10.1021/jm060873p
BindingDB Entry DOI: 10.7270/Q2F18WZB
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM14045
PNG
(Aminofurazanyl-azabenzimidazole 6l | N-(3-{[2-(4-a...)
Show SMILES CCn1c(nc2cnc(Oc3cccc(NC(=O)c4ccc(CN5CCOCC5)cc4)c3)cc12)-c1nonc1N
Show InChI InChI=1S/C28H28N8O4/c1-2-36-23-15-24(30-16-22(23)32-27(36)25-26(29)34-40-33-25)39-21-5-3-4-20(14-21)31-28(37)19-8-6-18(7-9-19)17-35-10-12-38-13-11-35/h3-9,14-16H,2,10-13,17H2,1H3,(H2,29,34)(H,31,37)
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n/an/a<1n/an/an/an/a7.422



GlaxoSmithKline



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP/[gamma-33P] ATP, the subsequent incorporation of 33P into the peptid...


J Med Chem 50: 2-5 (2007)


Article DOI: 10.1021/jm060873p
BindingDB Entry DOI: 10.7270/Q2F18WZB
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM14046
PNG
(Aminofurazanyl-azabenzimidazole 6m | N-(3-{[2-(4-a...)
Show SMILES CCn1c(nc2cnc(Oc3cccc(NC(=O)c4ccc(OCCN(C)C)cc4)c3)cc12)-c1nonc1N
Show InChI InChI=1S/C27H28N8O4/c1-4-35-22-15-23(29-16-21(22)31-26(35)24-25(28)33-39-32-24)38-20-7-5-6-18(14-20)30-27(36)17-8-10-19(11-9-17)37-13-12-34(2)3/h5-11,14-16H,4,12-13H2,1-3H3,(H2,28,33)(H,30,36)
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n/an/a<1n/an/an/an/a7.422



GlaxoSmithKline



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP/[gamma-33P] ATP, the subsequent incorporation of 33P into the peptid...


J Med Chem 50: 2-5 (2007)


Article DOI: 10.1021/jm060873p
BindingDB Entry DOI: 10.7270/Q2F18WZB
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM14047
PNG
(Aminofurazanyl-azabenzimidazole 6n | N-(3-{[2-(4-a...)
Show SMILES CCn1c(nc2cnc(Oc3cccc(NC(=O)c4ccc(OCCN5CCOCC5)cc4)c3)cc12)-c1nonc1N
Show InChI InChI=1S/C29H30N8O5/c1-2-37-24-17-25(31-18-23(24)33-28(37)26-27(30)35-42-34-26)41-22-5-3-4-20(16-22)32-29(38)19-6-8-21(9-7-19)40-15-12-36-10-13-39-14-11-36/h3-9,16-18H,2,10-15H2,1H3,(H2,30,35)(H,32,38)
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n/an/a 1.80n/an/an/an/a7.422



GlaxoSmithKline



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP/[gamma-33P] ATP, the subsequent incorporation of 33P into the peptid...


J Med Chem 50: 2-5 (2007)


Article DOI: 10.1021/jm060873p
BindingDB Entry DOI: 10.7270/Q2F18WZB
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM14048
PNG
(4-(4-fluorophenyl)-N-(1H-indazol-5-yl)-6-methyl-2-...)
Show SMILES CC1=NC(=O)NC(C1C(=O)Nc1ccc2[nH]ncc2c1)c1ccc(F)cc1
Show InChI InChI=1S/C19H16FN5O2/c1-10-16(17(24-19(27)22-10)11-2-4-13(20)5-3-11)18(26)23-14-6-7-15-12(8-14)9-21-25-15/h2-9,16-17H,1H3,(H,21,25)(H,23,26)(H,24,27)
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n/an/a 14n/an/an/an/a7.422



GlaxoSmithKline



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP/[gamma-33P] ATP, the subsequent incorporation of 33P into the peptid...


J Med Chem 50: 6-9 (2007)


Article DOI: 10.1021/jm0609014
BindingDB Entry DOI: 10.7270/Q298858V
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM14049
PNG
(4-(4-Fluorophenyl)-N-1H-indazol-5-yl-2-methyl-6-ox...)
Show SMILES CC1=C(C(CC(=O)N1)c1ccc(F)cc1)C(=O)Nc1ccc2[nH]ncc2c1
Show InChI InChI=1S/C20H17FN4O2/c1-11-19(16(9-18(26)23-11)12-2-4-14(21)5-3-12)20(27)24-15-6-7-17-13(8-15)10-22-25-17/h2-8,10,16H,9H2,1H3,(H,22,25)(H,23,26)(H,24,27)
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n/an/a 51n/an/an/an/a7.422



GlaxoSmithKline



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP/[gamma-33P] ATP, the subsequent incorporation of 33P into the peptid...


J Med Chem 50: 6-9 (2007)


Article DOI: 10.1021/jm0609014
BindingDB Entry DOI: 10.7270/Q298858V
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM14050
PNG
(N-(1H-indazol-5-yl)-2-methyl-6-oxo-4-[4-(trifluoro...)
Show SMILES CC1=C(C(CC(=O)N1)c1ccc(cc1)C(F)(F)F)C(=O)Nc1ccc2[nH]ncc2c1
Show InChI InChI=1S/C21H17F3N4O2/c1-11-19(20(30)27-15-6-7-17-13(8-15)10-25-28-17)16(9-18(29)26-11)12-2-4-14(5-3-12)21(22,23)24/h2-8,10,16H,9H2,1H3,(H,25,28)(H,26,29)(H,27,30)
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n/an/a 5n/an/an/an/a7.422



GlaxoSmithKline



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP/[gamma-33P] ATP, the subsequent incorporation of 33P into the peptid...


J Med Chem 50: 6-9 (2007)


Article DOI: 10.1021/jm0609014
BindingDB Entry DOI: 10.7270/Q298858V
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM14051
PNG
(4-(3,4-Dichlorophenyl)-N-1H-indazol-5-yl-2-methyl-...)
Show SMILES CC1=C(C(CC(=O)N1)c1ccc(Cl)c(Cl)c1)C(=O)Nc1ccc2[nH]ncc2c1
Show InChI InChI=1S/C20H16Cl2N4O2/c1-10-19(20(28)25-13-3-5-17-12(6-13)9-23-26-17)14(8-18(27)24-10)11-2-4-15(21)16(22)7-11/h2-7,9,14H,8H2,1H3,(H,23,26)(H,24,27)(H,25,28)
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n/an/a 8n/an/an/an/a7.422



GlaxoSmithKline



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP/[gamma-33P] ATP, the subsequent incorporation of 33P into the peptid...


J Med Chem 50: 6-9 (2007)


Article DOI: 10.1021/jm0609014
BindingDB Entry DOI: 10.7270/Q298858V
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM14052
PNG
(N-(1H-indazol-5-yl)-2-methyl-4-(naphthalen-2-yl)-6...)
Show SMILES CC1=C(C(CC(=O)N1)c1ccc2ccccc2c1)C(=O)Nc1ccc2[nH]ncc2c1
Show InChI InChI=1S/C24H20N4O2/c1-14-23(24(30)27-19-8-9-21-18(11-19)13-25-28-21)20(12-22(29)26-14)17-7-6-15-4-2-3-5-16(15)10-17/h2-11,13,20H,12H2,1H3,(H,25,28)(H,26,29)(H,27,30)
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n/an/a 9n/an/an/an/a7.422



GlaxoSmithKline



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP/[gamma-33P] ATP, the subsequent incorporation of 33P into the peptid...


J Med Chem 50: 6-9 (2007)


Article DOI: 10.1021/jm0609014
BindingDB Entry DOI: 10.7270/Q298858V
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM14053
PNG
(2-methyl-N-(3-methyl-1H-indazol-5-yl)-6-oxo-4-[4-(...)
Show SMILES Cc1n[nH]c2ccc(NC(=O)C3=C(C)NC(=O)CC3c3ccc(cc3)C(F)(F)F)cc12
Show InChI InChI=1S/C22H19F3N4O2/c1-11-16-9-15(7-8-18(16)29-28-11)27-21(31)20-12(2)26-19(30)10-17(20)13-3-5-14(6-4-13)22(23,24)25/h3-9,17H,10H2,1-2H3,(H,26,30)(H,27,31)(H,28,29)
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n/an/a 9n/an/an/an/a7.422



GlaxoSmithKline



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP/[gamma-33P] ATP, the subsequent incorporation of 33P into the peptid...


J Med Chem 50: 6-9 (2007)


Article DOI: 10.1021/jm0609014
BindingDB Entry DOI: 10.7270/Q298858V
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM25500
PNG
(4-(4-chloro-2-fluorophenyl)-N-(6-fluoro-1H-indazol...)
Show SMILES CC1=C(C(NC(=N1)c1ccnc(C)c1)c1ccc(Cl)cc1F)C(=O)Nc1cc2cn[nH]c2cc1F
Show InChI InChI=1S/C25H19ClF2N6O/c1-12-7-14(5-6-29-12)24-31-13(2)22(23(33-24)17-4-3-16(26)9-18(17)27)25(35)32-21-8-15-11-30-34-20(15)10-19(21)28/h3-11,23H,1-2H3,(H,30,34)(H,31,33)(H,32,35)
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n/an/a 10n/an/an/an/a7.422



GSK



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP33, and the incorporation of P33 into the peptide was quantified by Sc...


J Med Chem 51: 6631-4 (2008)


Article DOI: 10.1021/jm8005096
BindingDB Entry DOI: 10.7270/Q2F47MFZ
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM14055
PNG
(N-(6-fluoro-1H-indazol-5-yl)-2-methyl-6-oxo-4-[4-(...)
Show SMILES CC1=C(C(CC(=O)N1)c1ccc(cc1)C(F)(F)F)C(=O)Nc1cc2cn[nH]c2cc1F
Show InChI InChI=1S/C21H16F4N4O2/c1-10-19(20(31)28-17-6-12-9-26-29-16(12)8-15(17)22)14(7-18(30)27-10)11-2-4-13(5-3-11)21(23,24)25/h2-6,8-9,14H,7H2,1H3,(H,26,29)(H,27,30)(H,28,31)
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n/an/a 14n/an/an/an/a7.422



GlaxoSmithKline



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP/[gamma-33P] ATP, the subsequent incorporation of 33P into the peptid...


J Med Chem 50: 6-9 (2007)


Article DOI: 10.1021/jm0609014
BindingDB Entry DOI: 10.7270/Q298858V
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM14056
PNG
(N-(7-chloro-1H-indazol-5-yl)-2-methyl-6-oxo-4-[4-(...)
Show SMILES CC1=C(C(CC(=O)N1)c1ccc(cc1)C(F)(F)F)C(=O)Nc1cc(Cl)c2[nH]ncc2c1
Show InChI InChI=1S/C21H16ClF3N4O2/c1-10-18(20(31)28-14-6-12-9-26-29-19(12)16(22)7-14)15(8-17(30)27-10)11-2-4-13(5-3-11)21(23,24)25/h2-7,9,15H,8H2,1H3,(H,26,29)(H,27,30)(H,28,31)
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n/an/a 8n/an/an/an/a7.422



GlaxoSmithKline



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP/[gamma-33P] ATP, the subsequent incorporation of 33P into the peptid...


J Med Chem 50: 6-9 (2007)


Article DOI: 10.1021/jm0609014
BindingDB Entry DOI: 10.7270/Q298858V
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM14048
PNG
(4-(4-fluorophenyl)-N-(1H-indazol-5-yl)-6-methyl-2-...)
Show SMILES CC1=NC(=O)NC(C1C(=O)Nc1ccc2[nH]ncc2c1)c1ccc(F)cc1
Show InChI InChI=1S/C19H16FN5O2/c1-10-16(17(24-19(27)22-10)11-2-4-13(20)5-3-11)18(26)23-14-6-7-15-12(8-14)9-21-25-15/h2-9,16-17H,1H3,(H,21,25)(H,23,26)(H,24,27)
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n/an/a 14n/an/an/an/a7.422



GSK



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP33, and the incorporation of P33 into the peptide was quantified by Sc...


J Med Chem 51: 6631-4 (2008)


Article DOI: 10.1021/jm8005096
BindingDB Entry DOI: 10.7270/Q2F47MFZ
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM25477
PNG
(4-(4-fluorophenyl)-N-(1H-indazol-5-yl)-6-methyl-2-...)
Show SMILES CC1=C(C(NC(=N1)c1ccccc1)c1ccc(F)cc1)C(=O)Nc1ccc2[nH]ncc2c1
Show InChI InChI=1S/C25H20FN5O/c1-15-22(25(32)29-20-11-12-21-18(13-20)14-27-31-21)23(16-7-9-19(26)10-8-16)30-24(28-15)17-5-3-2-4-6-17/h2-14,23H,1H3,(H,27,31)(H,28,30)(H,29,32)
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n/an/a 105n/an/an/an/a7.422



GSK



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP33, and the incorporation of P33 into the peptide was quantified by Sc...


J Med Chem 51: 6631-4 (2008)


Article DOI: 10.1021/jm8005096
BindingDB Entry DOI: 10.7270/Q2F47MFZ
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM25478
PNG
(4-(4-fluorophenyl)-N-(1H-indazol-5-yl)-2-(4-methox...)
Show SMILES COc1ccc(cc1)C1=NC(C)=C(C(N1)c1ccc(F)cc1)C(=O)Nc1ccc2[nH]ncc2c1
Show InChI InChI=1S/C26H22FN5O2/c1-15-23(26(33)30-20-9-12-22-18(13-20)14-28-32-22)24(16-3-7-19(27)8-4-16)31-25(29-15)17-5-10-21(34-2)11-6-17/h3-14,24H,1-2H3,(H,28,32)(H,29,31)(H,30,33)
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n/an/a 46n/an/an/an/a7.422



GSK



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP33, and the incorporation of P33 into the peptide was quantified by Sc...


J Med Chem 51: 6631-4 (2008)


Article DOI: 10.1021/jm8005096
BindingDB Entry DOI: 10.7270/Q2F47MFZ
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM25479
PNG
(4-(4-fluorophenyl)-N-(1H-indazol-5-yl)-6-methyl-2-...)
Show SMILES CC1=C(C(NC(=N1)c1ccc(C)cc1)c1ccc(F)cc1)C(=O)Nc1ccc2[nH]ncc2c1
Show InChI InChI=1S/C26H22FN5O/c1-15-3-5-18(6-4-15)25-29-16(2)23(24(31-25)17-7-9-20(27)10-8-17)26(33)30-21-11-12-22-19(13-21)14-28-32-22/h3-14,24H,1-2H3,(H,28,32)(H,29,31)(H,30,33)
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n/an/a 101n/an/an/an/a7.422



GSK



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP33, and the incorporation of P33 into the peptide was quantified by Sc...


J Med Chem 51: 6631-4 (2008)


Article DOI: 10.1021/jm8005096
BindingDB Entry DOI: 10.7270/Q2F47MFZ
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM25480
PNG
(2-(3-fluoro-4-methylphenyl)-4-(4-fluorophenyl)-N-(...)
Show SMILES CC1=C(C(NC(=N1)c1ccc(C)c(F)c1)c1ccc(F)cc1)C(=O)Nc1ccc2[nH]ncc2c1
Show InChI InChI=1S/C26H21F2N5O/c1-14-3-4-17(12-21(14)28)25-30-15(2)23(24(32-25)16-5-7-19(27)8-6-16)26(34)31-20-9-10-22-18(11-20)13-29-33-22/h3-13,24H,1-2H3,(H,29,33)(H,30,32)(H,31,34)
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n/an/a 104n/an/an/an/a7.422



GSK



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP33, and the incorporation of P33 into the peptide was quantified by Sc...


J Med Chem 51: 6631-4 (2008)


Article DOI: 10.1021/jm8005096
BindingDB Entry DOI: 10.7270/Q2F47MFZ
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM25481
PNG
(2-(4-chlorophenyl)-4-(4-fluorophenyl)-N-(1H-indazo...)
Show SMILES CC1=C(C(NC(=N1)c1ccc(Cl)cc1)c1ccc(F)cc1)C(=O)Nc1ccc2[nH]ncc2c1
Show InChI InChI=1S/C25H19ClFN5O/c1-14-22(25(33)30-20-10-11-21-17(12-20)13-28-32-21)23(15-4-8-19(27)9-5-15)31-24(29-14)16-2-6-18(26)7-3-16/h2-13,23H,1H3,(H,28,32)(H,29,31)(H,30,33)
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n/an/a 129n/an/an/an/a7.422



GSK



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP33, and the incorporation of P33 into the peptide was quantified by Sc...


J Med Chem 51: 6631-4 (2008)


Article DOI: 10.1021/jm8005096
BindingDB Entry DOI: 10.7270/Q2F47MFZ
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM25482
PNG
(4-(4-fluorophenyl)-N-(1H-indazol-5-yl)-6-methyl-2-...)
Show SMILES CC1=C(C(NC(=N1)c1cccc(C)c1)c1ccc(F)cc1)C(=O)Nc1ccc2[nH]ncc2c1
Show InChI InChI=1S/C26H22FN5O/c1-15-4-3-5-18(12-15)25-29-16(2)23(24(31-25)17-6-8-20(27)9-7-17)26(33)30-21-10-11-22-19(13-21)14-28-32-22/h3-14,24H,1-2H3,(H,28,32)(H,29,31)(H,30,33)
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n/an/a 129n/an/an/an/a7.422



GSK



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP33, and the incorporation of P33 into the peptide was quantified by Sc...


J Med Chem 51: 6631-4 (2008)


Article DOI: 10.1021/jm8005096
BindingDB Entry DOI: 10.7270/Q2F47MFZ
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM25483
PNG
(4-(4-fluorophenyl)-N-(1H-indazol-5-yl)-6-methyl-2-...)
Show SMILES CC1=C(C(NC(=N1)c1ccncc1)c1ccc(F)cc1)C(=O)Nc1ccc2[nH]ncc2c1
Show InChI InChI=1S/C24H19FN6O/c1-14-21(24(32)29-19-6-7-20-17(12-19)13-27-31-20)22(15-2-4-18(25)5-3-15)30-23(28-14)16-8-10-26-11-9-16/h2-13,22H,1H3,(H,27,31)(H,28,30)(H,29,32)
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n/an/a 8n/an/an/an/a7.422



GSK



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP33, and the incorporation of P33 into the peptide was quantified by Sc...


J Med Chem 51: 6631-4 (2008)


Article DOI: 10.1021/jm8005096
BindingDB Entry DOI: 10.7270/Q2F47MFZ
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM25484
PNG
(4-(4-fluorophenyl)-N-(1H-indazol-5-yl)-6-methyl-2-...)
Show SMILES CC1=C(C(NC(=N1)c1cnccn1)c1ccc(F)cc1)C(=O)Nc1ccc2[nH]ncc2c1
Show InChI InChI=1S/C23H18FN7O/c1-13-20(23(32)29-17-6-7-18-15(10-17)11-27-31-18)21(14-2-4-16(24)5-3-14)30-22(28-13)19-12-25-8-9-26-19/h2-12,21H,1H3,(H,27,31)(H,28,30)(H,29,32)
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n/an/a 105n/an/an/an/a7.422



GSK



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP33, and the incorporation of P33 into the peptide was quantified by Sc...


J Med Chem 51: 6631-4 (2008)


Article DOI: 10.1021/jm8005096
BindingDB Entry DOI: 10.7270/Q2F47MFZ
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM25485
PNG
(4-(4-fluorophenyl)-N-(1H-indazol-5-yl)-6-methyl-2-...)
Show SMILES CC1=C(C(NC(=N1)c1cccc(c1)C(F)(F)F)c1ccc(F)cc1)C(=O)Nc1ccc2[nH]ncc2c1
Show InChI InChI=1S/C26H19F4N5O/c1-14-22(25(36)33-20-9-10-21-17(12-20)13-31-35-21)23(15-5-7-19(27)8-6-15)34-24(32-14)16-3-2-4-18(11-16)26(28,29)30/h2-13,23H,1H3,(H,31,35)(H,32,34)(H,33,36)
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n/an/a 288n/an/an/an/a7.422



GSK



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP33, and the incorporation of P33 into the peptide was quantified by Sc...


J Med Chem 51: 6631-4 (2008)


Article DOI: 10.1021/jm8005096
BindingDB Entry DOI: 10.7270/Q2F47MFZ
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM25486
PNG
(4-(4-fluorophenyl)-N-(1H-indazol-5-yl)-6-methyl-2-...)
Show SMILES CC1=C(C(NC(=N1)c1ccccn1)c1ccc(F)cc1)C(=O)Nc1ccc2[nH]ncc2c1
Show InChI InChI=1S/C24H19FN6O/c1-14-21(24(32)29-18-9-10-19-16(12-18)13-27-31-19)22(15-5-7-17(25)8-6-15)30-23(28-14)20-4-2-3-11-26-20/h2-13,22H,1H3,(H,27,31)(H,28,30)(H,29,32)
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n/an/a 180n/an/an/an/a7.422



GSK



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP33, and the incorporation of P33 into the peptide was quantified by Sc...


J Med Chem 51: 6631-4 (2008)


Article DOI: 10.1021/jm8005096
BindingDB Entry DOI: 10.7270/Q2F47MFZ
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM25487
PNG
(4-(4-fluorophenyl)-N-(1H-indazol-5-yl)-6-methyl-2-...)
Show SMILES CC1=C(C(NC(=N1)c1ccc(nc1)C(F)(F)F)c1ccc(F)cc1)C(=O)Nc1ccc2[nH]ncc2c1
Show InChI InChI=1S/C25H18F4N6O/c1-13-21(24(36)33-18-7-8-19-16(10-18)12-31-35-19)22(14-2-5-17(26)6-3-14)34-23(32-13)15-4-9-20(30-11-15)25(27,28)29/h2-12,22H,1H3,(H,31,35)(H,32,34)(H,33,36)
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n/an/a 75n/an/an/an/a7.422



GSK



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP33, and the incorporation of P33 into the peptide was quantified by Sc...


J Med Chem 51: 6631-4 (2008)


Article DOI: 10.1021/jm8005096
BindingDB Entry DOI: 10.7270/Q2F47MFZ
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM25488
PNG
(Dihydropyrimidine, 17 | N-(1H-indazol-5-yl)-4-(4-m...)
Show SMILES COc1ccc(cc1)C1=NC(C)=C(C(N1)c1ccc(cc1)S(C)(=O)=O)C(=O)Nc1ccc2[nH]ncc2c1
Show InChI InChI=1S/C27H25N5O4S/c1-16-24(27(33)30-20-8-13-23-19(14-20)15-28-32-23)25(17-6-11-22(12-7-17)37(3,34)35)31-26(29-16)18-4-9-21(36-2)10-5-18/h4-15,25H,1-3H3,(H,28,32)(H,29,31)(H,30,33)
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n/an/a 150n/an/an/an/a7.422



GSK



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP33, and the incorporation of P33 into the peptide was quantified by Sc...


J Med Chem 51: 6631-4 (2008)


Article DOI: 10.1021/jm8005096
BindingDB Entry DOI: 10.7270/Q2F47MFZ
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM25489
PNG
(Dihydropyrimidine, 18 | N-(1H-indazol-5-yl)-2-(4-m...)
Show SMILES COc1ccc(cc1)C1=NC(C)=C(C(C)N1)C(=O)Nc1ccc2[nH]ncc2c1
Show InChI InChI=1S/C21H21N5O2/c1-12-19(21(27)25-16-6-9-18-15(10-16)11-22-26-18)13(2)24-20(23-12)14-4-7-17(28-3)8-5-14/h4-12H,1-3H3,(H,22,26)(H,23,24)(H,25,27)
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n/an/a 863n/an/an/an/a7.422



GSK



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP33, and the incorporation of P33 into the peptide was quantified by Sc...


J Med Chem 51: 6631-4 (2008)


Article DOI: 10.1021/jm8005096
BindingDB Entry DOI: 10.7270/Q2F47MFZ
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM25490
PNG
(Dihydropyrimidine, 19 | N-(1H-indazol-5-yl)-2-(4-m...)
Show SMILES COc1ccc(cc1)C1=NC(C)=C(C(N1)c1ccc(cc1)S(N)(=O)=O)C(=O)Nc1ccc2[nH]ncc2c1
Show InChI InChI=1S/C26H24N6O4S/c1-15-23(26(33)30-19-7-12-22-18(13-19)14-28-32-22)24(16-5-10-21(11-6-16)37(27,34)35)31-25(29-15)17-3-8-20(36-2)9-4-17/h3-14,24H,1-2H3,(H,28,32)(H,29,31)(H,30,33)(H2,27,34,35)
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n/an/a 68n/an/an/an/a7.422



GSK



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP33, and the incorporation of P33 into the peptide was quantified by Sc...


J Med Chem 51: 6631-4 (2008)


Article DOI: 10.1021/jm8005096
BindingDB Entry DOI: 10.7270/Q2F47MFZ
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM25491
PNG
(4-[2-fluoro-4-(trifluoromethyl)phenyl]-N-(1H-indaz...)
Show SMILES COc1ccc(cc1)C1=NC(C)=C(C(N1)c1ccc(cc1F)C(F)(F)F)C(=O)Nc1ccc2[nH]ncc2c1
Show InChI InChI=1S/C27H21F4N5O2/c1-14-23(26(37)34-18-6-10-22-16(11-18)13-32-36-22)24(20-9-5-17(12-21(20)28)27(29,30)31)35-25(33-14)15-3-7-19(38-2)8-4-15/h3-13,24H,1-2H3,(H,32,36)(H,33,35)(H,34,37)
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n/an/a 26n/an/an/an/a7.422



GSK



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP33, and the incorporation of P33 into the peptide was quantified by Sc...


J Med Chem 51: 6631-4 (2008)


Article DOI: 10.1021/jm8005096
BindingDB Entry DOI: 10.7270/Q2F47MFZ
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM25492
PNG
(4-(4-chloro-2-fluorophenyl)-N-(1H-indazol-5-yl)-2-...)
Show SMILES COc1ccc(cc1)C1=NC(C)=C(C(N1)c1ccc(Cl)cc1F)C(=O)Nc1ccc2[nH]ncc2c1
Show InChI InChI=1S/C26H21ClFN5O2/c1-14-23(26(34)31-18-6-10-22-16(11-18)13-29-33-22)24(20-9-5-17(27)12-21(20)28)32-25(30-14)15-3-7-19(35-2)8-4-15/h3-13,24H,1-2H3,(H,29,33)(H,30,32)(H,31,34)
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n/an/a 5n/an/an/an/a7.422



GSK



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP33, and the incorporation of P33 into the peptide was quantified by Sc...


J Med Chem 51: 6631-4 (2008)


Article DOI: 10.1021/jm8005096
BindingDB Entry DOI: 10.7270/Q2F47MFZ
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM25493
PNG
(4-(4-chloro-2-fluorophenyl)-2-(2-chloropyridin-4-y...)
Show SMILES CC1=C(C(NC(=N1)c1ccnc(Cl)c1)c1ccc(Cl)cc1F)C(=O)Nc1ccc2[nH]ncc2c1
Show InChI InChI=1S/C24H17Cl2FN6O/c1-12-21(24(34)31-16-3-5-19-14(8-16)11-29-33-19)22(17-4-2-15(25)10-18(17)27)32-23(30-12)13-6-7-28-20(26)9-13/h2-11,22H,1H3,(H,29,33)(H,30,32)(H,31,34)
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n/an/a 4n/an/an/an/a7.422



GSK



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP33, and the incorporation of P33 into the peptide was quantified by Sc...


J Med Chem 51: 6631-4 (2008)


Article DOI: 10.1021/jm8005096
BindingDB Entry DOI: 10.7270/Q2F47MFZ
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM25494
PNG
(4-(4-chloro-2-fluorophenyl)-N-(1H-indazol-5-yl)-2-...)
Show SMILES COc1cc(ccn1)C1=NC(C)=C(C(N1)c1ccc(Cl)cc1F)C(=O)Nc1ccc2[nH]ncc2c1
Show InChI InChI=1S/C25H20ClFN6O2/c1-13-22(25(34)31-17-4-6-20-15(9-17)12-29-33-20)23(18-5-3-16(26)11-19(18)27)32-24(30-13)14-7-8-28-21(10-14)35-2/h3-12,23H,1-2H3,(H,29,33)(H,30,32)(H,31,34)
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n/an/a 2n/an/an/an/a7.422



GSK



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP33, and the incorporation of P33 into the peptide was quantified by Sc...


J Med Chem 51: 6631-4 (2008)


Article DOI: 10.1021/jm8005096
BindingDB Entry DOI: 10.7270/Q2F47MFZ
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM25495
PNG
(4-(4-chloro-2-fluorophenyl)-N-(1H-indazol-5-yl)-2-...)
Show SMILES COc1ccc(cn1)C1=NC(C)=C(C(N1)c1ccc(Cl)cc1F)C(=O)Nc1ccc2[nH]ncc2c1
Show InChI InChI=1S/C25H20ClFN6O2/c1-13-22(25(34)31-17-5-7-20-15(9-17)12-29-33-20)23(18-6-4-16(26)10-19(18)27)32-24(30-13)14-3-8-21(35-2)28-11-14/h3-12,23H,1-2H3,(H,29,33)(H,30,32)(H,31,34)
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n/an/a 3n/an/an/an/a7.422



GSK



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP33, and the incorporation of P33 into the peptide was quantified by Sc...


J Med Chem 51: 6631-4 (2008)


Article DOI: 10.1021/jm8005096
BindingDB Entry DOI: 10.7270/Q2F47MFZ
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (human))
BDBM25496
PNG
(4-(4-chloro-2-fluorophenyl)-2-(2-chloropyridin-4-y...)
Show SMILES CC1=C(C(NC(=N1)c1ccnc(Cl)c1)c1ccc(Cl)cc1F)C(=O)Nc1cc2cn[nH]c2cc1F
Show InChI InChI=1S/C24H16Cl2F2N6O/c1-11-21(24(35)32-19-6-13-10-30-34-18(13)9-17(19)28)22(15-3-2-14(25)8-16(15)27)33-23(31-11)12-4-5-29-20(26)7-12/h2-10,22H,1H3,(H,30,34)(H,31,33)(H,32,35)
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n/an/a 6n/an/an/an/a7.422



GSK



Assay Description
The assay of Rock-1 activity involved incubation with peptide substrate and ATP33, and the incorporation of P33 into the peptide was quantified by Sc...


J Med Chem 51: 6631-4 (2008)


Article DOI: 10.1021/jm8005096
BindingDB Entry DOI: 10.7270/Q2F47MFZ
More data for this
Ligand-Target Pair
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