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Compile Data Set for Download or QSAR

Found 5 hits Enz. Inhib. hit(s) with all data for entry = 50029248   
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
Protein kinase C alpha type


(Rattus norvegicus (Rat))
BDBM50280897
PNG
(CHEMBL281660 | Tetradecanoic acid (2S,3R)-2-(2-hyd...)
Show SMILES CCCCCCCCCCCCCC(=O)O[C@@H]1CC(=O)O[C@H]1CCO
Show InChI InChI=1S/C20H36O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-19(22)25-18-16-20(23)24-17(18)14-15-21/h17-18,21H,2-16H2,1H3/t17-,18+/m0/s1
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Article
880n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-PDBU binding to Protein kinase C alpha


Bioorg Med Chem Lett 4: 1369-1374 (1994)


Article DOI: 10.1016/S0960-894X(01)80364-4
BindingDB Entry DOI: 10.7270/Q2V98818
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Rattus norvegicus (Rat))
BDBM50282658
PNG
(((2R,3R)-2-Hydroxymethyl-5-oxo-tetrahydro-furan-3-...)
Show SMILES CCCCCCCCCCCCCCOC(=O)C[C@@H]1CC(=O)O[C@H]1CO
Show InChI InChI=1S/C21H38O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-25-20(23)15-18-16-21(24)26-19(18)17-22/h18-19,22H,2-17H2,1H3/t18-,19+/m1/s1
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Article
1.47E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-PDBU binding to Protein kinase C alpha


Bioorg Med Chem Lett 4: 1369-1374 (1994)


Article DOI: 10.1016/S0960-894X(01)80364-4
BindingDB Entry DOI: 10.7270/Q2V98818
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Rattus norvegicus (Rat))
BDBM50280896
PNG
(CHEMBL276429 | Tetradecanoic acid (2S,3R)-2-hydrox...)
Show SMILES CCCCCCCCCCCCCC(=O)O[C@@H]1CC(=O)O[C@H]1CO
Show InChI InChI=1S/C19H34O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-18(21)23-16-14-19(22)24-17(16)15-20/h16-17,20H,2-15H2,1H3/t16-,17+/m1/s1
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1.50E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-PDBU binding to Protein kinase C alpha


Bioorg Med Chem Lett 4: 1369-1374 (1994)


Article DOI: 10.1016/S0960-894X(01)80364-4
BindingDB Entry DOI: 10.7270/Q2V98818
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Rattus norvegicus (Rat))
BDBM50282661
PNG
(CHEMBL29762 | Tetradecanoic acid (2R,3S)-2-hydroxy...)
Show SMILES CCCCCCCCCCCCCC(=O)OC[C@@H]1CC(=O)O[C@H]1CO
Show InChI InChI=1S/C20H36O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-19(22)24-16-17-14-20(23)25-18(17)15-21/h17-18,21H,2-16H2,1H3/t17-,18-/m0/s1
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Article
3.10E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-PDBU binding to Protein kinase C alpha


Bioorg Med Chem Lett 4: 1369-1374 (1994)


Article DOI: 10.1016/S0960-894X(01)80364-4
BindingDB Entry DOI: 10.7270/Q2V98818
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Rattus norvegicus (Rat))
BDBM50282657
PNG
(CHEMBL29668 | [(2S,3R)-2-(2-Hydroxy-ethyl)-5-oxo-t...)
Show SMILES CCCCCCCCCCCCCCOC(=O)C[C@@H]1CC(=O)O[C@H]1CCO
Show InChI InChI=1S/C22H40O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-26-21(24)17-19-18-22(25)27-20(19)14-15-23/h19-20,23H,2-18H2,1H3/t19-,20+/m1/s1
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Article
1.86E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-PDBU binding to Protein kinase C alpha


Bioorg Med Chem Lett 4: 1369-1374 (1994)


Article DOI: 10.1016/S0960-894X(01)80364-4
BindingDB Entry DOI: 10.7270/Q2V98818
More data for this
Ligand-Target Pair