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BDBM50346677 CHEMBL1796866

SMILES: CO[C@H]1O[C@H](Cn2cc(COC(=O)[C@]34CCC(C)(C)C[C@H]3C3=CC[C@@H]5[C@@]6(C)CC[C@H](O)C(C)(C)[C@@H]6CC[C@@]5(C)[C@]3(C)CC4)nn2)[C@@H](O)[C@H](O)[C@H]1O

InChI Key: InChIKey=JLYZCQXCTVFWQY-HHZIXSNFSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50346677   
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
Glycogen phosphorylase, muscle form


(Oryctolagus cuniculus (rabbit))
BDBM50346677
PNG
(CHEMBL1796866)
Show SMILES CO[C@H]1O[C@H](Cn2cc(COC(=O)[C@]34CCC(C)(C)C[C@H]3C3=CC[C@@H]5[C@@]6(C)CC[C@H](O)C(C)(C)[C@@H]6CC[C@@]5(C)[C@]3(C)CC4)nn2)[C@@H](O)[C@H](O)[C@H]1O |r,t:22|
Show InChI InChI=1S/C40H63N3O8/c1-35(2)15-17-40(34(48)50-22-23-20-43(42-41-23)21-26-30(45)31(46)32(47)33(49-8)51-26)18-16-38(6)24(25(40)19-35)9-10-28-37(5)13-12-29(44)36(3,4)27(37)11-14-39(28,38)7/h9,20,25-33,44-47H,10-19,21-22H2,1-8H3/t25-,26+,27-,28+,29-,30+,31-,32+,33-,37-,38+,39+,40-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.14E+3n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of rabbit muscle glycogen phosphorylase A assessed as release of phosphate from glucose-1-phosphate after 25 mins by microplate reader bas...


Eur J Med Chem 46: 2011-21 (2011)


Article DOI: 10.1016/j.ejmech.2011.02.053
BindingDB Entry DOI: 10.7270/Q2DB826B
More data for this
Ligand-Target Pair
3D
3D Structure (docked)