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Compile Data Set for Download or QSAR

Found 5 hits Enz. Inhib. hit(s) with all data for entry = 50030069   
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 delta type


(Homo sapiens (Human))
BDBM50290875
PNG
((S)-13-Hydroxymethyl-10-((S)-isopropyl)-3,9,12-tri...)
Show SMILES CC(C)[C@@H]1Nc2cccc3[nH]cc(C[C@@H](CO)NC1=O)c23
Show InChI InChI=1S/C16H21N3O2/c1-9(2)15-16(21)18-11(8-20)6-10-7-17-12-4-3-5-13(19-15)14(10)12/h3-5,7,9,11,15,17,19-20H,6,8H2,1-2H3,(H,18,21)/t11-,15-/m0/s1
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Article
80n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]-PDBu from Protein kinase C delta


Bioorg Med Chem Lett 7: 2997-3000 (1997)


Article DOI: 10.1016/S0960-894X(97)10129-9
BindingDB Entry DOI: 10.7270/Q2RF5V05
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50290877
PNG
((3S,6S)-6-Hydroxymethyl-3-isopropyl-4-tetradecyl-p...)
Show SMILES CCCCCCCCCCCCCCN1C[C@@H](CO)NC(=O)[C@@H]1C(C)C
Show InChI InChI=1S/C22H44N2O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-24-17-20(18-25)23-22(26)21(24)19(2)3/h19-21,25H,4-18H2,1-3H3,(H,23,26)/t20-,21-/m0/s1
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290n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]-PDBu from Protein kinase C delta


Bioorg Med Chem Lett 7: 2997-3000 (1997)


Article DOI: 10.1016/S0960-894X(97)10129-9
BindingDB Entry DOI: 10.7270/Q2RF5V05
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50290876
PNG
((3S,6R)-6-Hydroxymethyl-3-isopropyl-4-tetradecyl-p...)
Show SMILES CCCCCCCCCCCCCCN1C[C@H](CO)NC(=O)[C@@H]1C(C)C
Show InChI InChI=1S/C22H44N2O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-24-17-20(18-25)23-22(26)21(24)19(2)3/h19-21,25H,4-18H2,1-3H3,(H,23,26)/t20-,21+/m1/s1
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2.70E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]-PDBu from Protein kinase C delta


Bioorg Med Chem Lett 7: 2997-3000 (1997)


Article DOI: 10.1016/S0960-894X(97)10129-9
BindingDB Entry DOI: 10.7270/Q2RF5V05
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50290874
PNG
((3R,6S)-6-Hydroxymethyl-3-isopropyl-4-tetradecyl-p...)
Show SMILES CCCCCCCCCCCCCCN1C[C@@H](CO)NC(=O)[C@H]1C(C)C
Show InChI InChI=1S/C22H44N2O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-24-17-20(18-25)23-22(26)21(24)19(2)3/h19-21,25H,4-18H2,1-3H3,(H,23,26)/t20-,21+/m0/s1
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6.50E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]-PDBu from Protein kinase C delta


Bioorg Med Chem Lett 7: 2997-3000 (1997)


Article DOI: 10.1016/S0960-894X(97)10129-9
BindingDB Entry DOI: 10.7270/Q2RF5V05
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50290873
PNG
((3R,6R)-6-Hydroxymethyl-3-isopropyl-4-tetradecyl-p...)
Show SMILES CCCCCCCCCCCCCCN1C[C@H](CO)NC(=O)[C@H]1C(C)C
Show InChI InChI=1S/C22H44N2O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-24-17-20(18-25)23-22(26)21(24)19(2)3/h19-21,25H,4-18H2,1-3H3,(H,23,26)/t20-,21-/m1/s1
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1.20E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]-PDBu from Protein kinase C delta


Bioorg Med Chem Lett 7: 2997-3000 (1997)


Article DOI: 10.1016/S0960-894X(97)10129-9
BindingDB Entry DOI: 10.7270/Q2RF5V05
More data for this
Ligand-Target Pair