Hydrogen Peroxide

Hydrogen Peroxide

SCHEMBL29033947

O=C1N=CNC1=Cc1ccc(O)cc1.OO

nearest known ligand 0.49

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 2/20 0.49
ALDH1A1 P00352 4/20 0.43
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
HPGD P15428 3/20 0.43
MAPT P10636 3/20 0.43
LMNA P02545 2/20 0.43
APAF1 O14727 1/20 0.43
THRB P10828 1/20 0.43
BLM P54132 1/20 0.43
METAP1 P53582 1/20 0.42
TDP1 Q9NUW8 2/20 0.41
AKR1B1 P15121 1/20 0.41
RAB9A P51151 1/20 0.41
CYP2C9 P11712 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
KDM4E B2RXH2 2/20 0.39
APEX1 P27695 1/20 0.39
F3 P13726 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL132173 0.98 GSK3B (0.50) GSK3BALDH1A1MEN1KMT2AHPGD
SCHEMBL132172 0.98 GSK3B (0.50) GSK3BALDH1A1MEN1KMT2AHPGD
SCHEMBL3781740 0.84 LMNA (0.46) ALDH1A1MEN1KMT2AHPGDMAPT
SCHEMBL16111885 0.77 MAPT (0.54) ALDH1A1MEN1KMT2AHPGDMAPT
SCHEMBL3714349 0.74 GSK3B (0.50) GSK3BALDH1A1MEN1KMT2AHPGD
SCHEMBL751632 0.74 GSK3B (0.50) GSK3BALDH1A1MEN1KMT2AHPGD
SCHEMBL751633 0.74 GSK3B (0.50) GSK3BALDH1A1MEN1KMT2AHPGD
SCHEMBL15954810 0.73 LRRK2 (0.38) ALDH1A1MEN1KMT2AMAPTKDM4E
SCHEMBL16111649 0.70 KMT2A (0.50) GSK3BALDH1A1MEN1KMT2AHPGD
4-Hydroxyphenylmethylene Hydantoin SCHEMBL8216459 0.66 GSK3B (1.00) GSK3BALDH1A1MEN1KMT2AHPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116444550-A Design method of novel probe CazFPC-SNAP and visual detection of protein aggregate 南京师范大学 2023-07-18 CN disclosed