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PubMed code 8893841

Compile data set for download or QSAR
Found 23 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))
BDBM2581
PNG
(3,13,23-triazahexacyclo[14.7.0.0^{2,10}.0^{4,9}.0^...)
Show SMILES O=C1NCc2c1c1c3ccccc3[nH]c1c1[nH]c3ccccc3c21
Show InChI InChI=1S/C20H13N3O/c24-20-17-12(9-21-20)15-10-5-1-3-7-13(10)22-18(15)19-16(17)11-6-2-4-8-14(11)23-19/h1-8,22-23H,9H2,(H,21,24)
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PubMed
n/an/a 2.45E+3n/an/an/an/an/an/a



Université Blaise Pascal

Curated by ChEMBL


Assay Description
Inhibition of Protein Kinase C(PKC)


J Med Chem 39: 4471-7 (1996)


Article DOI: 10.1021/jm9603779
BindingDB Entry DOI: 10.7270/Q2S181MM
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50054428
PNG
(13-(3,4-dihydroxy-6-hydroxymethyl-5-methoxytetrahy...)
Show SMILES COC1C(CO)OC(C(O)C1O)n1c2ccccc2c2c3C(=O)NCc3c3c4ccccc4[nH]c3c12
Show InChI InChI=1S/C27H25N3O6/c1-35-25-17(11-31)36-27(24(33)23(25)32)30-16-9-5-3-7-13(16)19-20-14(10-28-26(20)34)18-12-6-2-4-8-15(12)29-21(18)22(19)30/h2-9,17,23-25,27,29,31-33H,10-11H2,1H3,(H,28,34)
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PubMed
n/an/a 3.70E+3n/an/an/an/an/an/a



Université Blaise Pascal

Curated by ChEMBL


Assay Description
Inhibition of Protein Kinase C(PKC)


J Med Chem 39: 4471-7 (1996)


Article DOI: 10.1021/jm9603779
BindingDB Entry DOI: 10.7270/Q2S181MM
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50054426
PNG
(7-hydroxy-6,7,12,13-tetrahydro-5H-indolo[2,3-a]pyr...)
Show SMILES OC1NC(=O)c2c1c1c3ccccc3[nH]c1c1[nH]c3ccccc3c21
Show InChI InChI=1S/C20H13N3O2/c24-19-15-13-9-5-1-3-7-11(9)21-17(13)18-14(16(15)20(25)23-19)10-6-2-4-8-12(10)22-18/h1-8,19,21-22,24H,(H,23,25)
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PubMed
n/an/a 2.21E+4n/an/an/an/an/an/a



Université Blaise Pascal

Curated by ChEMBL


Assay Description
Inhibition of Protein Kinase C(PKC)


J Med Chem 39: 4471-7 (1996)


Article DOI: 10.1021/jm9603779
BindingDB Entry DOI: 10.7270/Q2S181MM
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50054423
PNG
(1,11-dichloro-13-(3,4-dihydroxy-6-hydroxymethyl-5-...)
Show SMILES COC1C(O)C(O)C(OC1CO)n1c2c(Cl)cccc2c2c3C(=O)NCc3c3c4cccc(Cl)c4[nH]c3c12
Show InChI InChI=1S/C27H23Cl2N3O6/c1-37-25-15(9-33)38-27(24(35)23(25)34)32-21-11(5-3-7-14(21)29)17-18-12(8-30-26(18)36)16-10-4-2-6-13(28)19(10)31-20(16)22(17)32/h2-7,15,23-25,27,31,33-35H,8-9H2,1H3,(H,30,36)
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PubMed
n/an/a 2.88E+4n/an/an/an/an/an/a



Université Blaise Pascal

Curated by ChEMBL


Assay Description
Inhibition of Protein Kinase C(PKC)


J Med Chem 39: 4471-7 (1996)


Article DOI: 10.1021/jm9603779
BindingDB Entry DOI: 10.7270/Q2S181MM
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50054429
PNG
(6-Hydroxy-12-(4-O-methyl-beta-D-glucopyrannosyl) -...)
Show SMILES COC1C(CO)OC(C(O)C1O)n1c2ccccc2c2c3C(=O)N(O)C(=O)c3c3c4ccccc4[nH]c3c12
Show InChI InChI=1S/C27H23N3O8/c1-37-24-15(10-31)38-27(23(33)22(24)32)29-14-9-5-3-7-12(14)17-19-18(25(34)30(36)26(19)35)16-11-6-2-4-8-13(11)28-20(16)21(17)29/h2-9,15,22-24,27-28,31-33,36H,10H2,1H3
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n/an/a 4.00E+4n/an/an/an/an/an/a



Université Blaise Pascal

Curated by ChEMBL


Assay Description
Inhibition of Protein Kinase C(PKC)


J Med Chem 39: 4471-7 (1996)


Article DOI: 10.1021/jm9603779
BindingDB Entry DOI: 10.7270/Q2S181MM
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50054425
PNG
(6-amino-6,7,12,13-tetrahydro-5H-indolo[2,3-a]pyrro...)
Show SMILES NN1C(=O)c2c(C1=O)c1c3ccccc3[nH]c1c1[nH]c3ccccc3c21
Show InChI InChI=1S/C20H12N4O2/c21-24-19(25)15-13-9-5-1-3-7-11(9)22-17(13)18-14(16(15)20(24)26)10-6-2-4-8-12(10)23-18/h1-8,22-23H,21H2
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n/an/a 4.35E+4n/an/an/an/an/an/a



Université Blaise Pascal

Curated by ChEMBL


Assay Description
Inhibition of Protein Kinase C(PKC)


J Med Chem 39: 4471-7 (1996)


Article DOI: 10.1021/jm9603779
BindingDB Entry DOI: 10.7270/Q2S181MM
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM2672
PNG
(3,13,23-triazahexacyclo[14.7.0.0^{2,10}.0^{4,9}.0^...)
Show SMILES O=C1NC(=O)c2c1c1c3ccccc3[nH]c1c1[nH]c3ccccc3c21
Show InChI InChI=1S/C20H11N3O2/c24-19-15-13-9-5-1-3-7-11(9)21-17(13)18-14(16(15)20(25)23-19)10-6-2-4-8-12(10)22-18/h1-8,21-22H,(H,23,24,25)
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n/an/a 4.47E+4n/an/an/an/an/an/a



Université Blaise Pascal

Curated by ChEMBL


Assay Description
Inhibition of Protein Kinase C(PKC)


J Med Chem 39: 4471-7 (1996)


Article DOI: 10.1021/jm9603779
BindingDB Entry DOI: 10.7270/Q2S181MM
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50054432
PNG
(1,11-Dichloro-6-hydroxy-12-(4-O-methyl-beta-D-gluc...)
Show SMILES COC1C(CO)OC(C(O)C1O)n1c2c(Cl)cccc2c2c3C(=O)N(O)C(=O)c3c3c4cccc(Cl)c4[nH]c3c12
Show InChI InChI=1S/C27H21Cl2N3O8/c1-39-24-13(8-33)40-27(23(35)22(24)34)31-20-10(5-3-7-12(20)29)15-17-16(25(36)32(38)26(17)37)14-9-4-2-6-11(28)18(9)30-19(14)21(15)31/h2-7,13,22-24,27,30,33-35,38H,8H2,1H3
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n/an/a 6.80E+4n/an/an/an/an/an/a



Université Blaise Pascal

Curated by ChEMBL


Assay Description
Inhibition of Protein Kinase C(PKC)


J Med Chem 39: 4471-7 (1996)


Article DOI: 10.1021/jm9603779
BindingDB Entry DOI: 10.7270/Q2S181MM
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50054434
PNG
(6-(4-Semicarbazido)-6,7,12,13-tetrahydro-5,7-dioxo...)
Show SMILES NNC(=O)NN1C(=O)c2c(C1=O)c1c3ccccc3[nH]c1c1[nH]c3ccccc3c21
Show InChI InChI=1S/C21H14N6O3/c22-25-21(30)26-27-19(28)15-13-9-5-1-3-7-11(9)23-17(13)18-14(16(15)20(27)29)10-6-2-4-8-12(10)24-18/h1-8,23-24H,22H2,(H2,25,26,30)
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n/an/a 7.80E+4n/an/an/an/an/an/a



Université Blaise Pascal

Curated by ChEMBL


Assay Description
Inhibition of Protein Kinase C(PKC)


J Med Chem 39: 4471-7 (1996)


Article DOI: 10.1021/jm9603779
BindingDB Entry DOI: 10.7270/Q2S181MM
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50054422
PNG
(6-hydroxy-6,7,12,13-tetrahydro-5H-indolo[2,3-a]pyr...)
Show SMILES ON1C(=O)c2c(C1=O)c1c3ccccc3[nH]c1c1[nH]c3ccccc3c21
Show InChI InChI=1S/C20H11N3O3/c24-19-15-13-9-5-1-3-7-11(9)21-17(13)18-14(16(15)20(25)23(19)26)10-6-2-4-8-12(10)22-18/h1-8,21-22,26H
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n/an/a 7.92E+4n/an/an/an/an/an/a



Université Blaise Pascal

Curated by ChEMBL


Assay Description
Inhibition of Protein Kinase C(PKC)


J Med Chem 39: 4471-7 (1996)


Article DOI: 10.1021/jm9603779
BindingDB Entry DOI: 10.7270/Q2S181MM
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50054421
PNG
(1,11-dichloro-6,7,12,13-tetrahydro-5H-indolo[2,3-a...)
Show SMILES Clc1cccc2c1[nH]c1c3[nH]c4c(Cl)cccc4c3c3C(=O)NC(=O)c3c21
Show InChI InChI=1S/C20H9Cl2N3O2/c21-9-5-1-3-7-11-13-14(20(27)25-19(13)26)12-8-4-2-6-10(22)16(8)24-18(12)17(11)23-15(7)9/h1-6,23-24H,(H,25,26,27)
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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(PKC)


J Med Chem 39: 4471-7 (1996)


Article DOI: 10.1021/jm9603779
BindingDB Entry DOI: 10.7270/Q2S181MM
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50054433
PNG
(6-(2-Hydroxyethyl)6,7,12,13-tetrahydro-5,7-dioxoin...)
Show SMILES OCCN1C(=O)c2c(C1=O)c1c3ccccc3[nH]c1c1[nH]c3ccccc3c21
Show InChI InChI=1S/C22H15N3O3/c26-10-9-25-21(27)17-15-11-5-1-3-7-13(11)23-19(15)20-16(18(17)22(25)28)12-6-2-4-8-14(12)24-20/h1-8,23-24,26H,9-10H2
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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(PKC)


J Med Chem 39: 4471-7 (1996)


Article DOI: 10.1021/jm9603779
BindingDB Entry DOI: 10.7270/Q2S181MM
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50054418
PNG
(1,11-dichloro-6,7,12,13-tetrahydro-5H-indolo[2,3-a...)
Show SMILES Clc1cccc2c1[nH]c1c3[nH]c4c(Cl)cccc4c3c3C(=O)NCc3c21
Show InChI InChI=1S/C20H11Cl2N3O/c21-11-5-1-3-8-13-10-7-23-20(26)15(10)14-9-4-2-6-12(22)17(9)25-19(14)18(13)24-16(8)11/h1-6,24-25H,7H2,(H,23,26)
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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(PKC)


J Med Chem 39: 4471-7 (1996)


Article DOI: 10.1021/jm9603779
BindingDB Entry DOI: 10.7270/Q2S181MM
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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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(PKC)


J Med Chem 39: 4471-7 (1996)


Article DOI: 10.1021/jm9603779
BindingDB Entry DOI: 10.7270/Q2S181MM
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50054435
PNG
(6-Amino-1,11-dichloro-6,7,12,13-tetrahydro-5,7-dio...)
Show SMILES NN1C(=O)c2c(C1=O)c1c3cccc(Cl)c3[nH]c1c1[nH]c3c(Cl)cccc3c21
Show InChI InChI=1S/C20H10Cl2N4O2/c21-9-5-1-3-7-11-13-14(20(28)26(23)19(13)27)12-8-4-2-6-10(22)16(8)25-18(12)17(11)24-15(7)9/h1-6,24-25H,23H2
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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(PKC)


J Med Chem 39: 4471-7 (1996)


Article DOI: 10.1021/jm9603779
BindingDB Entry DOI: 10.7270/Q2S181MM
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50054437
PNG
(6-Amino-1,11-dichloro-12-(4-O-methyl-beta-D-glucop...)
Show SMILES COC1C(CO)OC(C(O)C1O)n1c2c(Cl)cccc2c2c3C(=O)N(N)C(=O)c3c3c4cccc(Cl)c4[nH]c3c12
Show InChI InChI=1S/C27H22Cl2N4O7/c1-39-24-13(8-34)40-27(23(36)22(24)35)32-20-10(5-3-7-12(20)29)15-17-16(25(37)33(30)26(17)38)14-9-4-2-6-11(28)18(9)31-19(14)21(15)32/h2-7,13,22-24,27,31,34-36H,8,30H2,1H3
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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(PKC)


J Med Chem 39: 4471-7 (1996)


Article DOI: 10.1021/jm9603779
BindingDB Entry DOI: 10.7270/Q2S181MM
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50054436
PNG
(6-Formamido-6,7,12,13-tetrahydro-5,7-dioxoindolo[2...)
Show SMILES O=CNN1C(=O)c2c(C1=O)c1c3ccccc3[nH]c1c1[nH]c3ccccc3c21
Show InChI InChI=1S/C21H12N4O3/c26-9-22-25-20(27)16-14-10-5-1-3-7-12(10)23-18(14)19-15(17(16)21(25)28)11-6-2-4-8-13(11)24-19/h1-9,23-24H,(H,22,26)
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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(PKC)


J Med Chem 39: 4471-7 (1996)


Article DOI: 10.1021/jm9603779
BindingDB Entry DOI: 10.7270/Q2S181MM
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50054427
PNG
(6-Formamido-1,11-dichloro-6,7,12,13-tetrahydro-5,7...)
Show SMILES Clc1cccc2c1[nH]c1c3[nH]c4c(Cl)cccc4c3c3C(=O)N(NC=O)C(=O)c3c21
Show InChI InChI=1S/C21H10Cl2N4O3/c22-10-5-1-3-8-12-14-15(21(30)27(20(14)29)24-7-28)13-9-4-2-6-11(23)17(9)26-19(13)18(12)25-16(8)10/h1-7,25-26H,(H,24,28)
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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(PKC)


J Med Chem 39: 4471-7 (1996)


Article DOI: 10.1021/jm9603779
BindingDB Entry DOI: 10.7270/Q2S181MM
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50054430
PNG
(1,11-Dichloro-6-formamido-12-(4-O-methyl-beta-D-gl...)
Show SMILES COC1C(CO)OC(C(O)C1O)n1c2c(Cl)cccc2c2c3C(=O)N(NC=O)C(=O)c3c3c4cccc(Cl)c4[nH]c3c12
Show InChI InChI=1S/C28H22Cl2N4O8/c1-41-25-14(8-35)42-28(24(38)23(25)37)33-21-11(5-3-7-13(21)30)16-18-17(26(39)34(27(18)40)31-9-36)15-10-4-2-6-12(29)19(10)32-20(15)22(16)33/h2-7,9,14,23-25,28,32,35,37-38H,8H2,1H3,(H,31,36)
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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(PKC)


J Med Chem 39: 4471-7 (1996)


Article DOI: 10.1021/jm9603779
BindingDB Entry DOI: 10.7270/Q2S181MM
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
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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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(PKC)


J Med Chem 39: 4471-7 (1996)


Article DOI: 10.1021/jm9603779
BindingDB Entry DOI: 10.7270/Q2S181MM
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50054419
PNG
(1,11-dichloro-7-hydroxy-6,7,12,13-tetrahydro-5H-in...)
Show SMILES OC1NC(=O)c2c1c1c3cccc(Cl)c3[nH]c1c1[nH]c3c(Cl)cccc3c21
Show InChI InChI=1S/C20H11Cl2N3O2/c21-9-5-1-3-7-11-13-14(20(27)25-19(13)26)12-8-4-2-6-10(22)16(8)24-18(12)17(11)23-15(7)9/h1-6,19,23-24,26H,(H,25,27)
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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(PKC)


J Med Chem 39: 4471-7 (1996)


Article DOI: 10.1021/jm9603779
BindingDB Entry DOI: 10.7270/Q2S181MM
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50054438
PNG
(6-Amino-12-(4-O-methyl-beta-D-glucopyrannosyl) -6,...)
Show SMILES COC1C(CO)OC(C(O)C1O)n1c2ccccc2c2c3C(=O)N(N)C(=O)c3c3c4ccccc4[nH]c3c12
Show InChI InChI=1S/C27H24N4O7/c1-37-24-15(10-32)38-27(23(34)22(24)33)30-14-9-5-3-7-12(14)17-19-18(25(35)31(28)26(19)36)16-11-6-2-4-8-13(11)29-20(16)21(17)30/h2-9,15,22-24,27,29,32-34H,10,28H2,1H3
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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(PKC)


J Med Chem 39: 4471-7 (1996)


Article DOI: 10.1021/jm9603779
BindingDB Entry DOI: 10.7270/Q2S181MM
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50054431
PNG
(6-Formamido-12-(4-O-methyl-beta-D-glucopyrannosyl)...)
Show SMILES COC1C(CO)OC(C(O)C1O)n1c2ccccc2c2c3C(=O)N(NC=O)C(=O)c3c3c4ccccc4[nH]c3c12
Show InChI InChI=1S/C28H24N4O8/c1-39-25-16(10-33)40-28(24(36)23(25)35)31-15-9-5-3-7-13(15)18-20-19(26(37)32(27(20)38)29-11-34)17-12-6-2-4-8-14(12)30-21(17)22(18)31/h2-9,11,16,23-25,28,30,33,35-36H,10H2,1H3,(H,29,34)
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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(PKC)


J Med Chem 39: 4471-7 (1996)


Article DOI: 10.1021/jm9603779
BindingDB Entry DOI: 10.7270/Q2S181MM
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%