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BDBM50260525 PUNICAFOLIN::Punicafolin

SMILES: [H][C@]12COC(=O)c3cc(O)c(O)c(O)c3-c3c(O)c(O)c(O)cc3C(=O)O[C@]([H])([C@@H](OC(=O)c3cc(O)c(O)c(O)c3)[C@H](OC(=O)c3cc(O)c(O)c(O)c3)O1)[C@@H]2OC(=O)c1cc(O)c(O)c(O)c1

InChI Key: InChIKey=DPBVYZVSXAZMAY-UUUCSUBKSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50260525   
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 (PKC)


(Homo sapiens (Human))
BDBM50260525
PNG
(PUNICAFOLIN | Punicafolin)
Show SMILES [H][C@]12COC(=O)c3cc(O)c(O)c(O)c3-c3c(O)c(O)c(O)cc3C(=O)O[C@]([H])([C@@H](OC(=O)c3cc(O)c(O)c(O)c3)[C@H](OC(=O)c3cc(O)c(O)c(O)c3)O1)[C@@H]2OC(=O)c1cc(O)c(O)c(O)c1 |r|
Show InChI InChI=1S/C41H30O26/c42-15-1-10(2-16(43)26(15)50)36(57)64-33-23-9-62-39(60)13-7-21(48)29(53)31(55)24(13)25-14(8-22(49)30(54)32(25)56)40(61)65-34(33)35(66-37(58)11-3-17(44)27(51)18(45)4-11)41(63-23)67-38(59)12-5-19(46)28(52)20(47)6-12/h1-8,23,33-35,41-56H,9H2/t23-,33-,34+,35-,41+/m1/s1
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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PC cid
PC sid
UniChem

Similars

Article
n/an/a 4.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibitory activity against protein kinase C (PKC)


Citation and Details

Article DOI: 10.1016/S0960-894X(01)81072-6
BindingDB Entry DOI: 10.7270/Q2G44T0S
More data for this
Ligand-Target Pair