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Articleid 50029331

Compile data set for download or QSAR
Found 6 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
Protein kinase C alpha type


(Bos taurus (bovine))
BDBM50283474
PNG
(Acetic acid (2S,3R)-2-hydroxymethyl-6-oxo-5-tetrad...)
Show SMILES CCCCCCCCCCCCC\C=C1/C[C@@H](OC(C)=O)[C@H](CO)OC1=O
Show InChI InChI=1S/C22H38O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-16-20(26-18(2)24)21(17-23)27-22(19)25/h15,20-21,23H,3-14,16-17H2,1-2H3/b19-15+/t20-,21+/m1/s1
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Article
200n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H-20]-phorbol-12-13-dibutyrate from bovine brain protein kinase C alpha


Bioorg Med Chem Lett 4: 2405-2410 (1994)


Article DOI: 10.1016/S0960-894X(01)80399-1
BindingDB Entry DOI: 10.7270/Q2765F8Q
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Bos taurus (bovine))
BDBM50281846
PNG
((2R,3R)-2-Hydroxymethyl-5-oxo-4-tridec-(E)-ylidene...)
Show SMILES CCCCCCCCCCCCC\C=C1\[C@@H](OC(C)=O)[C@H](CO)OC1=O
Show InChI InChI=1S/C21H36O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-20(25-17(2)23)19(16-22)26-21(18)24/h15,19-20,22H,3-14,16H2,1-2H3/b18-15-/t19-,20+/m0/s1
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Article
200n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H-20]-phorbol-12-13-dibutyrate from bovine brain protein kinase C alpha


Bioorg Med Chem Lett 4: 2405-2410 (1994)


Article DOI: 10.1016/S0960-894X(01)80399-1
BindingDB Entry DOI: 10.7270/Q2765F8Q
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Bos taurus (bovine))
BDBM50281845
PNG
((2R,3R)-2-Hydroxymethyl-5-oxo-4-tridec-(E)-ylidene...)
Show SMILES CCCCCCCCCCCCC\C=C1/[C@@H](OC(C)=O)[C@H](CO)OC1=O
Show InChI InChI=1S/C21H36O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-20(25-17(2)23)19(16-22)26-21(18)24/h15,19-20,22H,3-14,16H2,1-2H3/b18-15+/t19-,20+/m0/s1
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Article
300n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H-20]-phorbol-12-13-dibutyrate from bovine brain protein kinase C alpha


Bioorg Med Chem Lett 4: 2405-2410 (1994)


Article DOI: 10.1016/S0960-894X(01)80399-1
BindingDB Entry DOI: 10.7270/Q2765F8Q
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Bos taurus (bovine))
BDBM50283473
PNG
(Acetic acid (2S,3R)-2-hydroxymethyl-6-oxo-5-tetrad...)
Show SMILES CCCCCCCCCCCCC\C=C1\C[C@@H](OC(C)=O)[C@H](CO)OC1=O
Show InChI InChI=1S/C22H38O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-16-20(26-18(2)24)21(17-23)27-22(19)25/h15,20-21,23H,3-14,16-17H2,1-2H3/b19-15-/t20-,21+/m1/s1
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Article
1.30E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H-20]-phorbol-12-13-dibutyrate from bovine brain protein kinase C alpha


Bioorg Med Chem Lett 4: 2405-2410 (1994)


Article DOI: 10.1016/S0960-894X(01)80399-1
BindingDB Entry DOI: 10.7270/Q2765F8Q
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Bos taurus (bovine))
BDBM50283471
PNG
(Acetic acid (2S,3R)-2-hydroxymethyl-6-oxo-5-tetrad...)
Show SMILES CCCCCCCCCCCCCCC1C[C@@H](OC(C)=O)[C@H](CO)OC1=O
Show InChI InChI=1S/C22H40O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-16-20(26-18(2)24)21(17-23)27-22(19)25/h19-21,23H,3-17H2,1-2H3/t19?,20-,21+/m1/s1
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Article
1.90E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H-20]-phorbol-12-13-dibutyrate from bovine brain protein kinase C alpha


Bioorg Med Chem Lett 4: 2405-2410 (1994)


Article DOI: 10.1016/S0960-894X(01)80399-1
BindingDB Entry DOI: 10.7270/Q2765F8Q
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Bos taurus (bovine))
BDBM50283475
PNG
(CHEMBL78679 | Tetradecanoic acid (2R,4S)-2-hydroxy...)
Show SMILES CCCCCCCCCCCCCC(=O)O[C@H]1C[C@H](CO)OC(=O)C1
Show InChI InChI=1S/C20H36O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-19(22)24-17-14-18(16-21)25-20(23)15-17/h17-18,21H,2-16H2,1H3/t17-,18+/m0/s1
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Article
2.05E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H-20]-phorbol-12-13-dibutyrate from bovine brain protein kinase C alpha


Bioorg Med Chem Lett 4: 2405-2410 (1994)


Article DOI: 10.1016/S0960-894X(01)80399-1
BindingDB Entry DOI: 10.7270/Q2765F8Q
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%