UCSF

ZINC36160875

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 22 No

Popular Name: (2R,3S,4R,5R,6S)-6-[2-(2,5-dioxopyrrolidin-1-yl)ethoxy]-3,4,5-trihydroxy-tetrahydropyran-2-carboxyli (2R,3S,4R,5R,6S)-6-[2-(2,5-dioxo…

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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) -3.07 -1.92 -55.42 3 10 -1 157 318.258 5 ↓

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
FGF2-1-E Basic Fibroblast Growth Factor (cluster #1 Of 1), Eukaryotic Eukaryotes 340 0.41 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
FGF2_HUMAN P09038 Basic Fibroblast Growth Factor, Human 340 0.41 Binding ≤ 1μM
FGF2_HUMAN P09038 Basic Fibroblast Growth Factor, Human 340 0.41 Binding ≤ 10μM

Reactome Annotations from Targets (via Uniprot)

Description Species
Activated point mutants of FGFR2
Constitutive PI3K/AKT Signaling in Cancer
FGFR1b ligand binding and activation
FGFR1c ligand binding and activation
FGFR2c ligand binding and activation
FGFR3c ligand binding and activation
FGFR4 ligand binding and activation
FRS2-mediated cascade
Negative regulation of FGFR signaling
Non-integrin membrane-ECM interactions
Phospholipase C-mediated cascade
PI-3K cascade
PI3K Cascade
PIP3 activates AKT signaling
POU5F1 (OCT4), SOX2, NANOG activate genes related to proliferation
SHC-mediated cascade
Signaling by activated point mutants of FGFR1
Signaling by activated point mutants of FGFR3
Signaling by FGFR mutants
Signaling by FGFR3 mutants
Syndecan interactions

Rings

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