Athraquinones A

Athraquinones A

SCHEMBL28256830

C(OCC1CO1)C1CO1.O=C1c2ccccc2C(=O)c2c1ccc(O)c2O

nearest known ligand 0.63

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.63
MEN1 O00255 7/20 0.63
KMT2A Q03164 7/20 0.63
ALDH1A1 P00352 5/20 0.63
MAPK1 P28482 4/20 0.63
MAOA P21397 4/20 0.63
MCL1 Q07820 4/20 0.63
HPGD P15428 4/20 0.63
KDM4E B2RXH2 3/20 0.63
CYP3A4 P08684 3/20 0.63
ALOX15 P16050 3/20 0.63
RECQL P46063 3/20 0.63
HSD17B10 Q99714 3/20 0.63
SMN1; SMN2 Q16637 3/20 0.63
APEX1 P27695 2/20 0.63
BCL2 P10415 2/20 0.63
ALOX12 P18054 2/20 0.63
DAPK1 P53355 2/20 0.63
CYP1B1 Q16678 2/20 0.63
ELANE P08246 5/20 0.49

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
Anthraquinone SCHEMBL14723446 0.83 TDP1 (0.48) MAPTMEN1KMT2AALDH1A1MAPK1
Athraquinones A SCHEMBL4972786 0.80 MAPT (1.00) MAPTMEN1KMT2AALDH1A1MAPK1
Athraquinones A SCHEMBL29373337 0.80 MAPT (1.00) MAPTMEN1KMT2AALDH1A1MAPK1
Athraquinones A SCHEMBL21114402 0.80 MAPT (1.00) MAPTMEN1KMT2AALDH1A1MAPK1
Athraquinones A SCHEMBL18614 0.80 MAPT (1.00) MAPTMEN1KMT2AALDH1A1MAPK1
Athraquinones A SCHEMBL11805858 0.78 MAPT (0.96) MAPTMEN1KMT2AALDH1A1MAPK1
Athraquinones A SCHEMBL22471867 0.78 MAPT (0.96) MAPTMEN1KMT2AALDH1A1MAPK1
Athraquinones A SCHEMBL30498009 0.78 MAPT (0.96) MAPTMEN1KMT2AALDH1A1MAPK1
Athraquinones A SCHEMBL3228431 0.78 MAPT (0.96) MAPTMEN1KMT2AALDH1A1MAPK1
Athraquinones A SCHEMBL7839563 0.78 MAPT (0.96) MAPTMEN1KMT2AALDH1A1MAPK1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109071412-B Amine compound, amine composition and epoxy resin curing agent 三菱瓦斯化学株式会社 2021-06-01 CN disclosed
CN-109071412-A Amine compounds, amine composition and epoxy curing agent 三菱瓦斯化学株式会社 2018-12-21 CN disclosed