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BDBM50204625 CHEMBL220962::methyl 16-{4-[2-(4-{2-[4-({[2-(Hydroxymethyl)-4-(methylethylidene)-5-oxo-2-2,3dihydrofuryl]methyl}oxycarbonyl)phenyl]ethynyl}phenyl)ethynyl]phenoxy}hexadecanoate

SMILES: [#6]-[#8]-[#6](=O)-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#8]-c1ccc(cc1)C#Cc1ccc(cc1)C#Cc1ccc(cc1)-[#6](=O)-[#8]-[#6]C1([#6]-[#8])[#6]\[#6](=[#6](/[#6])-[#6])-[#6](=O)-[#8]1

InChI Key: InChIKey=SRUKHZJJQCUVKU-UHFFFAOYNA-N

Data: 1 KI

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50204625   
Target
(Institution)
LigandTarget
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
PKC alpha and beta-2


(Homo sapiens (human))
BDBM50204625
PNG
(CHEMBL220962 | methyl 16-{4-[2-(4-{2-[4-({[2-(Hydr...)
Show SMILES [#6]-[#8]-[#6](=O)-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#8]-c1ccc(cc1)C#Cc1ccc(cc1)C#Cc1ccc(cc1)-[#6](=O)-[#8]-[#6]C1([#6]-[#8])[#6]\[#6](=[#6](/[#6])-[#6])-[#6](=O)-[#8]1
Show InChI InChI=1/C49H58O8/c1-38(2)45-35-49(36-50,57-48(45)53)37-56-47(52)43-30-26-41(27-31-43)24-22-39-18-20-40(21-19-39)23-25-42-28-32-44(33-29-42)55-34-16-14-12-10-8-6-4-5-7-9-11-13-15-17-46(51)54-3/h18-21,26-33,50H,4-17,34-37H2,1-3H3
PDB
MMDB

NCI pathway
SMPDB pathway
KEGG

UniProtKB/SwissProt

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

Similars

AffyNet 
Article
PubMed
53n/an/an/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Displacement of [3H]PDBu from PKCalpha


J Med Chem 50: 962-78 (2007)

More data for this
Ligand-Target Pair