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PubMed code 15801821

Compile data set for download or QSAR
Found 5 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
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (Human))
BDBM15186
PNG
(4-(5-{[(5E)-2-amino-3,7-dicyano-4,6-dimethyl-5H-cy...)
Show SMILES Cc1c(C#N)c(N)[nH]c2c(C#N)c(=C)c(=Cc3ccc(o3)-c3ccc(C(O)=O)c(Cl)c3)c12 |w:15.15|
Show InChI InChI=1S/C24H15ClN4O3/c1-11-16(21-12(2)18(10-27)23(28)29-22(21)17(11)9-26)8-14-4-6-20(32-14)13-3-5-15(24(30)31)19(25)7-13/h3-8,29H,1,28H2,2H3,(H,30,31)
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PubMed
1.10E+3 -34.0 2.60E+3n/an/an/an/a7.525



The Burnham Institute



Assay Description
The Z-LYTE assay (Invitrogen Corporation) employs a FRET-based, coupled-enzyme format and is based on the differential sensitivity of phosphorylated ...


J Med Chem 48: 2278-81 (2005)


Article DOI: 10.1021/jm048962u
BindingDB Entry DOI: 10.7270/Q2KD1W4Z
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (Human))
BDBM15187
PNG
(3-[(2E)-3-(1H-1,3-benzodiazol-2-yl)prop-2-enoyl]-6...)
Show SMILES Clc1ccc2[nH]c(=O)c(C(=O)\C=C\c3nc4ccccc4[nH]3)c(-c3ccccc3)c2c1
Show InChI InChI=1S/C25H16ClN3O2/c26-16-10-11-18-17(14-16)23(15-6-2-1-3-7-15)24(25(31)29-18)21(30)12-13-22-27-19-8-4-5-9-20(19)28-22/h1-14H,(H,27,28)(H,29,31)/b13-12+
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PubMed
3.90E+3 -30.9 4.50E+3n/an/an/an/a7.525



The Burnham Institute



Assay Description
The Z-LYTE assay (Invitrogen Corporation) employs a FRET-based, coupled-enzyme format and is based on the differential sensitivity of phosphorylated ...


J Med Chem 48: 2278-81 (2005)


Article DOI: 10.1021/jm048962u
BindingDB Entry DOI: 10.7270/Q2KD1W4Z
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (Human))
BDBM15188
PNG
(5-{5-[(1,3-dioxo-2,3-dihydro-1H-inden-2-ylidene)me...)
Show SMILES [#8]-[#6](=O)-c1cc(ccc1-[#8])-c1ccc(\[#6]=[#6]-2/[#6](=O)-c3ccccc3-[#6]-2=O)o1
Show InChI InChI=1S/C21H12O6/c22-17-7-5-11(9-15(17)21(25)26)18-8-6-12(27-18)10-16-19(23)13-3-1-2-4-14(13)20(16)24/h1-10,22H,(H,25,26)
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Article
PubMed
2.08E+4 -26.7 2.51E+4n/an/an/an/a7.525



The Burnham Institute



Assay Description
The Z-LYTE assay (Invitrogen Corporation) employs a FRET-based, coupled-enzyme format and is based on the differential sensitivity of phosphorylated ...


J Med Chem 48: 2278-81 (2005)


Article DOI: 10.1021/jm048962u
BindingDB Entry DOI: 10.7270/Q2KD1W4Z
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (Human))
BDBM15190
PNG
(3-(5-{[(5E)-2-amino-3,7-dicyano-4,6-dimethyl-5H-cy...)
Show SMILES Cc1c(C#N)c(N)[nH]c2c(C#N)c(=C)c(=Cc3ccc(o3)-c3cccc(c3)C(O)=O)c12 |w:15.15|
Show InChI InChI=1S/C24H16N4O3/c1-12-17(21-13(2)19(11-26)23(27)28-22(21)18(12)10-25)9-16-6-7-20(31-16)14-4-3-5-15(8-14)24(29)30/h3-9,28H,1,27H2,2H3,(H,29,30)
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PubMed
n/an/a 6.02E+4n/an/an/an/a7.525



The Burnham Institute



Assay Description
The Z-LYTE assay (Invitrogen Corporation) employs a FRET-based, coupled-enzyme format and is based on the differential sensitivity of phosphorylated ...


J Med Chem 48: 2278-81 (2005)


Article DOI: 10.1021/jm048962u
BindingDB Entry DOI: 10.7270/Q2KD1W4Z
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (Human))
BDBM15189
PNG
(4-(5-{[(5E)-2-amino-3,7-dicyano-4,6-dimethyl-5H-cy...)
Show SMILES Cc1c(C#N)c(N)[nH]c2c(C#N)c(=C)c(=Cc3ccc(o3)-c3ccc(cc3)C(O)=O)c12 |w:15.15|
Show InChI InChI=1S/C24H16N4O3/c1-12-17(21-13(2)19(11-26)23(27)28-22(21)18(12)10-25)9-16-7-8-20(31-16)14-3-5-15(6-4-14)24(29)30/h3-9,28H,1,27H2,2H3,(H,29,30)
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Article
PubMed
n/an/a 1.26E+5n/an/an/an/a7.525



The Burnham Institute



Assay Description
The Z-LYTE assay (Invitrogen Corporation) employs a FRET-based, coupled-enzyme format and is based on the differential sensitivity of phosphorylated ...


J Med Chem 48: 2278-81 (2005)


Article DOI: 10.1021/jm048962u
BindingDB Entry DOI: 10.7270/Q2KD1W4Z
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%