UCSF

ZINC05131852

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 23rd, 2006 13 Yes

Popular Name: alpha-Homonojirimycin alpha-Homonojirimycin

Find On: PubMed — Wikipedia — Google

CAS Numbers: 119557-99-2 , [119557-99-2]

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -3.05 -12.28 -29.67 7 6 1 117 194.207 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 207 TCI

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
D3ZJF9-1-E Alpha-galactosidase A (cluster #1 Of 1), Eukaryotic Eukaryotes 4500 0.58 Binding ≤ 10μM
GANC-1-E Neutral Alpha-glucosidase C (cluster #1 Of 2), Eukaryotic Eukaryotes 22 0.82 Binding ≤ 10μM
GDE-1-E Glycogen Debranching Enzyme (cluster #1 Of 1), Eukaryotic Eukaryotes 110 0.75 Binding ≤ 10μM
LYAG-1-E Alpha-glucosidase (cluster #1 Of 2), Eukaryotic Eukaryotes 8400 0.55 Binding ≤ 10μM
MGA-1-E Maltase-glucoamylase (cluster #1 Of 3), Eukaryotic Eukaryotes 8400 0.55 Binding ≤ 10μM
SUIS-1-E Sucrase-isomaltase (cluster #1 Of 3), Eukaryotic Eukaryotes 700 0.66 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
LYAG_RAT Q6P7A9 Acidic Alpha-glucosidase, Rat 170 0.73 Binding ≤ 1μM
GDE_RABIT P35574 Glycogen Debranching Enzyme, Rabit 110 0.75 Binding ≤ 1μM
LYAG_HUMAN P10253 Lysosomal Alpha-glucosidase, Human 100 0.75 Binding ≤ 1μM
MGA_HUMAN O43451 Maltase-glucoamylase, Human 40 0.80 Binding ≤ 1μM
GANC_HUMAN Q8TET4 Neutral Alpha-glucosidase C, Human 22 0.82 Binding ≤ 1μM
SUIS_RAT P23739 Sucrase-isomaltase, Rat 170 0.73 Binding ≤ 1μM
LYAG_RAT Q6P7A9 Acidic Alpha-glucosidase, Rat 170 0.73 Binding ≤ 10μM
D3ZJF9_RAT D3ZJF9 Alpha-galactosidase A, Rat 4500 0.58 Binding ≤ 10μM
GDE_RABIT P35574 Glycogen Debranching Enzyme, Rabit 110 0.75 Binding ≤ 10μM
LYAG_HUMAN P10253 Lysosomal Alpha-glucosidase, Human 100 0.75 Binding ≤ 10μM
MGA_HUMAN O43451 Maltase-glucoamylase, Human 40 0.80 Binding ≤ 10μM
GANC_HUMAN Q8TET4 Neutral Alpha-glucosidase C, Human 22 0.82 Binding ≤ 10μM
SUIS_RAT P23739 Sucrase-isomaltase, Rat 170 0.73 Binding ≤ 10μM

Reactome Annotations from Targets (via Uniprot)

Description Species
Digestion of dietary carbohydrate
Glycosphingolipid metabolism

Analogs ( Draw Identity 99% 90% 80% 70% )