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PubMed code 9341921

Compile data set for download or QSAR
Found 7 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


(Homo sapiens (Human))
BDBM50060400
PNG
(6-methyl-12-(3,4,5-trihydroxy-6-hydroxymethyltetra...)
Show SMILES CN1C(=O)c2c(C1=O)c1c3ccccc3n(C3OC(CO)C(O)C(O)C3O)c1c1[nH]c3ccccc3c21
Show InChI InChI=1S/C27H23N3O7/c1-29-25(35)18-16-11-6-2-4-8-13(11)28-20(16)21-17(19(18)26(29)36)12-7-3-5-9-14(12)30(21)27-24(34)23(33)22(32)15(10-31)37-27/h2-9,15,22-24,27-28,31-34H,10H2,1H3
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Article
PubMed
n/an/a 6.20E+4n/an/an/an/an/an/a



Université Blaise Pascal

Curated by ChEMBL


Assay Description
Inhibition of Protein kinase C alpha


J Med Chem 40: 3456-65 (1997)


Article DOI: 10.1021/jm9702084
BindingDB Entry DOI: 10.7270/Q2T72GJ6
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50060401
PNG
(6-methyl-12-(3,4,5-trihydroxy-6-methyltetrahydro-2...)
Show SMILES CC1OC(C(O)C(O)C1O)n1c2ccccc2c2c3C(=O)N(C)C(=O)c3c3c4ccccc4[nH]c3c12
Show InChI InChI=1S/C27H23N3O6/c1-11-22(31)23(32)24(33)27(36-11)30-15-10-6-4-8-13(15)17-19-18(25(34)29(2)26(19)35)16-12-7-3-5-9-14(12)28-20(16)21(17)30/h3-11,22-24,27-28,31-33H,1-2H3
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Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Université Blaise Pascal

Curated by ChEMBL


Assay Description
Inhibition of Protein kinase C alpha


J Med Chem 40: 3456-65 (1997)


Article DOI: 10.1021/jm9702084
BindingDB Entry DOI: 10.7270/Q2T72GJ6
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50060402
PNG
(3,5-di(methylcarbonyloxy)-2-methylcarbonyloxymethy...)
Show SMILES CN1C(=O)c2c(C1=O)c1c3ccccc3n(C3OC(COC(C)=O)C(OC(C)=O)C(OC(C)=O)C3OC(C)=O)c1c1[nH]c3ccccc3c21
Show InChI InChI=1S/C35H31N3O11/c1-15(39)45-14-23-30(46-16(2)40)31(47-17(3)41)32(48-18(4)42)35(49-23)38-22-13-9-7-11-20(22)25-27-26(33(43)37(5)34(27)44)24-19-10-6-8-12-21(19)36-28(24)29(25)38/h6-13,23,30-32,35-36H,14H2,1-5H3
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PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Université Blaise Pascal

Curated by ChEMBL


Assay Description
Inhibition of Protein kinase C alpha


J Med Chem 40: 3456-65 (1997)


Article DOI: 10.1021/jm9702084
BindingDB Entry DOI: 10.7270/Q2T72GJ6
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50060403
PNG
(1,11-dichloro-12-(3,4-dihydroxy-6-hydroxymethyl-5-...)
Show SMILES COC1C(CO)OC(C(O)C1O)n1c2c(Cl)cccc2c2c3C(=O)N(C)C(=O)c3c3c4cccc(Cl)c4[nH]c3c12
Show InChI InChI=1S/C28H23Cl2N3O7/c1-32-26(37)17-15-10-5-3-7-12(29)19(10)31-20(15)22-16(18(17)27(32)38)11-6-4-8-13(30)21(11)33(22)28-24(36)23(35)25(39-2)14(9-34)40-28/h3-8,14,23-25,28,31,34-36H,9H2,1-2H3
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Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Université Blaise Pascal

Curated by ChEMBL


Assay Description
Inhibition of Protein kinase C alpha


J Med Chem 40: 3456-65 (1997)


Article DOI: 10.1021/jm9702084
BindingDB Entry DOI: 10.7270/Q2T72GJ6
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50162287
PNG
((Rebeccamycin)1,11-dichloro-12-(3,4-dihydroxy-6-hy...)
Show SMILES CO[C@@H]1[C@@H](CO)O[C@H]([C@H](O)[C@H]1O)n1c2c(Cl)cccc2c2c3C(=O)NC(=O)c3c3c4cccc(Cl)c4[nH]c3c12 |r|
Show InChI InChI=1S/C27H21Cl2N3O7/c1-38-24-13(8-33)39-27(23(35)22(24)34)32-20-10(5-3-7-12(20)29)15-17-16(25(36)31-26(17)37)14-9-4-2-6-11(28)18(9)30-19(14)21(15)32/h2-7,13,22-24,27,30,33-35H,8H2,1H3,(H,31,36,37)/t13-,22-,23-,24-,27-/m1/s1
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Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Université Blaise Pascal

Curated by ChEMBL


Assay Description
Inhibition of Protein kinase C alpha


J Med Chem 40: 3456-65 (1997)


Article DOI: 10.1021/jm9702084
BindingDB Entry DOI: 10.7270/Q2T72GJ6
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50054420
PNG
(12-(3,4-dihydroxy-6-hydroxymethyl-5-methoxytetrahy...)
Show SMILES COC1C(CO)OC(C(O)C1O)n1c2ccccc2c2c3C(=O)NC(=O)c3c3c4ccccc4[nH]c3c12
Show InChI InChI=1S/C27H23N3O7/c1-36-24-15(10-31)37-27(23(33)22(24)32)30-14-9-5-3-7-12(14)17-19-18(25(34)29-26(19)35)16-11-6-2-4-8-13(11)28-20(16)21(17)30/h2-9,15,22-24,27-28,31-33H,10H2,1H3,(H,29,34,35)
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Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Université Blaise Pascal

Curated by ChEMBL


Assay Description
Inhibition of Protein kinase C alpha


J Med Chem 40: 3456-65 (1997)


Article DOI: 10.1021/jm9702084
BindingDB Entry DOI: 10.7270/Q2T72GJ6
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50060404
PNG
(12-(3,4-dihydroxy-6-hydroxymethyl-5-methoxytetrahy...)
Show SMILES COC1C(CO)OC(C(O)C1O)n1c2ccccc2c2c3C(=O)N(C)C(=O)c3c3c4ccccc4[nH]c3c12
Show InChI InChI=1S/C28H25N3O7/c1-30-26(35)19-17-12-7-3-5-9-14(12)29-21(17)22-18(20(19)27(30)36)13-8-4-6-10-15(13)31(22)28-24(34)23(33)25(37-2)16(11-32)38-28/h3-10,16,23-25,28-29,32-34H,11H2,1-2H3
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Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Université Blaise Pascal

Curated by ChEMBL


Assay Description
Inhibition of Protein kinase C alpha


J Med Chem 40: 3456-65 (1997)


Article DOI: 10.1021/jm9702084
BindingDB Entry DOI: 10.7270/Q2T72GJ6
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%