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BDBM50363877 CHEMBL1232636

SMILES: OC[C@H]1O[C@@H](NC(=O)NC(=O)c2ccc(Cl)cc2)[C@H](O)[C@@H](O)[C@@H]1O

InChI Key: InChIKey=YTUMHTAWGXUOIS-BZNQNGANSA-N

Data: 1 KI

PDB links: 1 PDB ID matches this monomer.

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50363877   
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))
BDBM50363877
PNG
(CHEMBL1232636)
Show SMILES OC[C@H]1O[C@@H](NC(=O)NC(=O)c2ccc(Cl)cc2)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C14H17ClN2O7/c15-7-3-1-6(2-4-7)12(22)16-14(23)17-13-11(21)10(20)9(19)8(5-18)24-13/h1-4,8-11,13,18-21H,5H2,(H2,16,17,22,23)/t8-,9-,10+,11-,13-/m1/s1
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KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
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CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem

Similars

MMDB
PDB
Article
PubMed
4.40E+3n/an/an/an/an/an/an/an/a



University of Debrecen

Curated by ChEMBL


Assay Description
Inhibition of rabbit muscle glycogen phosphorylase b assessed as inorganic phosphate release at pH 6.8


Bioorg Med Chem 20: 1801-16 (2012)


Article DOI: 10.1016/j.bmc.2011.12.059
BindingDB Entry DOI: 10.7270/Q2SN09DD
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)