BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 8 hits Enz. Inhib. hit(s) with all data for entry = 50009251   
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))
BDBM50081616
PNG
(CHEMBL132879 | Tetradecanoic acid 2-hydroxymethyl-...)
Show SMILES CCCCCCCCCCCCCC(=O)OCC1(CO)C\C(CO1)=C\C(=O)OC
Show InChI InChI=1S/C23H40O6/c1-3-4-5-6-7-8-9-10-11-12-13-14-21(25)28-19-23(18-24)16-20(17-29-23)15-22(26)27-2/h15,24H,3-14,16-19H2,1-2H3/b20-15-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
350n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Displacement of [3H-20]-phorbol 12,13-dibutyrate(PDBU) from recombinant Protein kinase C alpha


J Med Chem 42: 4129-39 (1999)


BindingDB Entry DOI: 10.7270/Q23R0S30
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50081615
PNG
(CHEMBL133165 | Tetradecanoic acid 2-hydroxymethyl-...)
Show SMILES CCCCCCCCCCCCCC(=O)OCC1(CO)C\C(CO1)=C/C(=O)OC
Show InChI InChI=1S/C23H40O6/c1-3-4-5-6-7-8-9-10-11-12-13-14-21(25)28-19-23(18-24)16-20(17-29-23)15-22(26)27-2/h15,24H,3-14,16-19H2,1-2H3/b20-15+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
350n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Displacement of [3H-20]-phorbol 12,13-dibutyrate(PDBU) from recombinant Protein kinase C alpha


J Med Chem 42: 4129-39 (1999)


BindingDB Entry DOI: 10.7270/Q23R0S30
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50081619
PNG
(CHEMBL133269 | [5-Acetoxymethyl-5-hydroxymethyl-di...)
Show SMILES CCCCCCCCCCCCCCCCCCOC(=O)\C=C1/COC(CO)(COC(C)=O)C1
Show InChI InChI=1S/C28H50O6/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-32-27(31)20-26-21-28(23-29,34-22-26)24-33-25(2)30/h20,29H,3-19,21-24H2,1-2H3/b26-20-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
580n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Displacement of [3H-20]-phorbol 12,13-dibutyrate(PDBU) from recombinant Protein kinase C alpha


J Med Chem 42: 4129-39 (1999)


BindingDB Entry DOI: 10.7270/Q23R0S30
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50081620
PNG
(CHEMBL132843 | [5-Acetoxymethyl-5-hydroxymethyl-di...)
Show SMILES CCCCCCCCCCCCCCCCCCOC(=O)\C=C1\COC(CO)(COC(C)=O)C1
Show InChI InChI=1S/C28H50O6/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-32-27(31)20-26-21-28(23-29,34-22-26)24-33-25(2)30/h20,29H,3-19,21-24H2,1-2H3/b26-20+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
1.86E+3n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Displacement of [3H-20]-phorbol 12,13-dibutyrate(PDBU) from recombinant Protein kinase C alpha


J Med Chem 42: 4129-39 (1999)


BindingDB Entry DOI: 10.7270/Q23R0S30
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50081621
PNG
(CHEMBL133960 | Hexanoic acid (2R,5R)-2-hydroxymeth...)
Show SMILES CCCCCCCCCCCCCCOC(=O)C[C@H]1CC[C@@](CO)(COC(=O)CCCCC)O1
Show InChI InChI=1S/C28H52O6/c1-3-5-7-8-9-10-11-12-13-14-15-17-21-32-27(31)22-25-19-20-28(23-29,34-25)24-33-26(30)18-16-6-4-2/h25,29H,3-24H2,1-2H3/t25-,28-/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
2.38E+3n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Displacement of [3H-20]-phorbol 12,13-dibutyrate(PDBU) from recombinant Protein kinase C alpha


J Med Chem 42: 4129-39 (1999)


BindingDB Entry DOI: 10.7270/Q23R0S30
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50081618
PNG
(CHEMBL131645 | Tetradecanoic acid (2R,5R)-2-hydrox...)
Show SMILES CCCCCCCCCCCCCC(=O)OC[C@]1(CO)CC[C@H](CC(=O)OC)O1
Show InChI InChI=1S/C23H42O6/c1-3-4-5-6-7-8-9-10-11-12-13-14-21(25)28-19-23(18-24)16-15-20(29-23)17-22(26)27-2/h20,24H,3-19H2,1-2H3/t20-,23-/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
2.72E+3n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Displacement of [3H-20]-phorbol 12,13-dibutyrate(PDBU) from recombinant Protein kinase C alpha


J Med Chem 42: 4129-39 (1999)


BindingDB Entry DOI: 10.7270/Q23R0S30
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50081617
PNG
(CHEMBL422089 | Tetradecanoic acid (2R,5S)-2-hydrox...)
Show SMILES CCCCCCCCCCCCCC(=O)OC[C@]1(CO)CC[C@@H](CC(=O)OC)O1
Show InChI InChI=1S/C23H42O6/c1-3-4-5-6-7-8-9-10-11-12-13-14-21(25)28-19-23(18-24)16-15-20(29-23)17-22(26)27-2/h20,24H,3-19H2,1-2H3/t20-,23+/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
1.08E+4n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Displacement of [3H-20]-phorbol 12,13-dibutyrate(PDBU) from recombinant Protein kinase C alpha


J Med Chem 42: 4129-39 (1999)


BindingDB Entry DOI: 10.7270/Q23R0S30
More data for this
Ligand-Target Pair
Protein kinase C alpha type


(Homo sapiens (Human))
BDBM50081614
PNG
(CHEMBL133170 | Hexanoic acid (2R,5S)-2-hydroxymeth...)
Show SMILES CCCCCCCCCCCCCCOC(=O)C[C@@H]1CC[C@@](CO)(COC(=O)CCCCC)O1
Show InChI InChI=1S/C28H52O6/c1-3-5-7-8-9-10-11-12-13-14-15-17-21-32-27(31)22-25-19-20-28(23-29,34-25)24-33-26(30)18-16-6-4-2/h25,29H,3-24H2,1-2H3/t25-,28+/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
1.28E+4n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Displacement of [3H-20]-phorbol 12,13-dibutyrate(PDBU) from recombinant Protein kinase C alpha


J Med Chem 42: 4129-39 (1999)


BindingDB Entry DOI: 10.7270/Q23R0S30
More data for this
Ligand-Target Pair