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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Protein kinase C delta type' and Ligand = 'BDBM50491405'   
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))
BDBM50491405
PNG
(CHEMBL2381160)
Show SMILES [H][C@@]12CCC(C)(C)[C@]3(C[C@@]([H])(C[C@@H](CCCCc4cc(O)ccc4NC(C)=O)O3)OC(=O)C[C@H](CO)OC(=O)C1)O2 |r|
Show InChI InChI=1S/C29H41NO9/c1-18(32)30-25-9-8-20(33)12-19(25)6-4-5-7-21-13-23-16-29(38-21)28(2,3)11-10-22(39-29)14-26(34)37-24(17-31)15-27(35)36-23/h8-9,12,21-24,31,33H,4-7,10-11,13-17H2,1-3H3,(H,30,32)/t21-,22-,23-,24-,29+/m1/s1
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
690n/an/an/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Inhibition of [3H]PDBu binding to PKCdelta-C1B domain peptide (unknown origin)


Bioorg Med Chem 21: 2695-702 (2013)


Article DOI: 10.1016/j.bmc.2013.03.013
BindingDB Entry DOI: 10.7270/Q26M39RD
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50491405
PNG
(CHEMBL2381160)
Show SMILES [H][C@@]12CCC(C)(C)[C@]3(C[C@@]([H])(C[C@@H](CCCCc4cc(O)ccc4NC(C)=O)O3)OC(=O)C[C@H](CO)OC(=O)C1)O2 |r|
Show InChI InChI=1S/C29H41NO9/c1-18(32)30-25-9-8-20(33)12-19(25)6-4-5-7-21-13-23-16-29(38-21)28(2,3)11-10-22(39-29)14-26(34)37-24(17-31)15-27(35)36-23/h8-9,12,21-24,31,33H,4-7,10-11,13-17H2,1-3H3,(H,30,32)/t21-,22-,23-,24-,29+/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
8.70E+3n/an/an/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Inhibition of [3H]PDBu binding to PKCdelta-C1A domain peptide (unknown origin)


Bioorg Med Chem 21: 2695-702 (2013)


Article DOI: 10.1016/j.bmc.2013.03.013
BindingDB Entry DOI: 10.7270/Q26M39RD
More data for this
Ligand-Target Pair