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BDBM50057735 (3,4,5-Trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yl)-acetonitrile::CHEMBL133447

SMILES: [H][C@@]1(CC#N)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

InChI Key: InChIKey=GUAMQCQSVFTRNN-BZCSJUTBSA-N

Data: 3 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50057735   
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
Muscle glycogen phosphorylase


(Homo sapiens (Human))
BDBM50057735
PNG
((3,4,5-Trihydroxy-6-hydroxymethyl-tetrahydro-pyran...)
Show SMILES [H][C@@]1(CC#N)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1S/C8H13NO5/c9-2-1-4-6(11)8(13)7(12)5(3-10)14-4/h4-8,10-13H,1,3H2/t4-,5+,6-,7+,8+/m0/s1
PDB
MMDB

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PC cid
PC sid
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Similars

Article
PubMed
8.91E+6n/an/an/an/an/an/an/an/a



University of Alcala

Curated by ChEMBL


Assay Description
Inhibitory activity against rabbit muscle glycogen phosphorylase


J Med Chem 40: 4089-102 (1998)

Checked by Author
Article DOI: 10.1021/jm970273d
BindingDB Entry DOI: 10.7270/Q2S46TGM
More data for this
Ligand-Target Pair
Brain glycogen phosphorylase


(Homo sapiens (Human))
BDBM50057735
PNG
((3,4,5-Trihydroxy-6-hydroxymethyl-tetrahydro-pyran...)
Show SMILES [H][C@@]1(CC#N)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1S/C8H13NO5/c9-2-1-4-6(11)8(13)7(12)5(3-10)14-4/h4-8,10-13H,1,3H2/t4-,5+,6-,7+,8+/m0/s1
PDB

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antibodypedia
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PC sid
UniChem

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Article
PubMed
9.00E+6n/an/an/an/an/an/an/an/a



University of Perugia

Curated by ChEMBL


Assay Description
Inhibition of rabbit glycogen phosphorylase B enzyme


J Med Chem 40: 1455-64 (1997)


Article DOI: 10.1021/jm9608016
BindingDB Entry DOI: 10.7270/Q26T0N9N
More data for this
Ligand-Target Pair
Brain glycogen phosphorylase


(Homo sapiens (Human))
BDBM50057735
PNG
((3,4,5-Trihydroxy-6-hydroxymethyl-tetrahydro-pyran...)
Show SMILES [H][C@@]1(CC#N)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1S/C8H13NO5/c9-2-1-4-6(11)8(13)7(12)5(3-10)14-4/h4-8,10-13H,1,3H2/t4-,5+,6-,7+,8+/m0/s1
PDB

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KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.00E+11n/an/an/an/an/an/an/an/a



Philipps-Universit£t Marburg

Curated by ChEMBL


Assay Description
Inhibitory activity against Pig Skeletal Glycogen Phosphorylase b


J Med Chem 45: 4153-70 (2002)


Article DOI: 10.1021/jm020808p
BindingDB Entry DOI: 10.7270/Q2KH0R3H
More data for this
Ligand-Target Pair