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BDBM50133244 CHEMBL134287::Hexadecanedioic acid 4-(2-hydroxymethyl-4-isopropyl-5-oxo-pyrrolidin-3-yl)-naphthalen-1-yl ester naphthalen 4-(2-hydroxymethyl-4-isopropyl-5-oxo-pyrrolidin-3-yl)-1-yl ester

SMILES: CC(C)[C@@H]1C([C@@H](CO)NC1=O)c1ccc(OC(=O)CCCCCCCCCCCCCCC(=O)Oc2ccc([C@@H]3[C@@H](CO)NC(=O)[C@@H]3C(C)C)c3ccccc23)c2ccccc12

InChI Key: InChIKey=PDYZULBASCNBLF-LHBDIWRGSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50133244   
Target/Host
(Institution)
LigandTarget/Host
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
Protein Kinase C, alpha


(Bos taurus (bovine))
BDBM50133244
PNG
(CHEMBL134287 | Hexadecanedioic acid 4-(2-hydroxyme...)
Show SMILES CC(C)[C@@H]1C([C@@H](CO)NC1=O)c1ccc(OC(=O)CCCCCCCCCCCCCCC(=O)Oc2ccc([C@@H]3[C@@H](CO)NC(=O)[C@@H]3C(C)C)c3ccccc23)c2ccccc12
Show InChI InChI=1S/C52H68N2O8/c1-33(2)47-49(41(31-55)53-51(47)59)39-27-29-43(37-23-19-17-21-35(37)39)61-45(57)25-15-13-11-9-7-5-6-8-10-12-14-16-26-46(58)62-44-30-28-40(36-22-18-20-24-38(36)44)50-42(32-56)54-52(60)48(50)34(3)4/h17-24,27-30,33-34,41-42,47-50,55-56H,5-16,25-26,31-32H2,1-4H3,(H,53,59)(H,54,60)/t41-,42-,47-,48-,49-,50?/m1/s1
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MMDB

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PC cid
PC sid
UniChem
Article
PubMed
254n/an/an/an/an/an/an/an/a



Georgetown University Medical Center

Curated by ChEMBL


Assay Description
Tested for ability to displace [20e3] phorbol 12,13- dibutyrate binding from recombinant bovine Protein kinase C alpha in presence of [Ca2+]


J Med Chem 46: 4196-204 (2003)


Article DOI: 10.1021/jm0302041
BindingDB Entry DOI: 10.7270/Q2GF0SX2
More data for this
Ligand-Target Pair