Anthraquinone

Anthraquinone

SCHEMBL28355802

O=C1c2ccccc2C(=O)c2ccccc21.O=CO.c1c[nH]cn1

nearest known ligand 0.45

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.45
FKBP5 Q13451 1/20 0.45
MAOA P21397 2/20 0.43
MAOB P27338 1/20 0.43
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CDC25B P30305 2/20 0.41
BCL2 P10415 1/20 0.37
MCL1 Q07820 1/20 0.37
MAPT P10636 4/20 0.37
RAB9A P51151 3/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
NPC1 O15118 2/20 0.37
HSD17B10 Q99714 2/20 0.37
TP53 P04637 2/20 0.37
MAPK10 P53779 1/20 0.37
TDP2 O95551 3/20 0.36
APAF1 O14727 2/20 0.36
LMNA P02545 3/20 0.35
POLB P06746 3/20 0.35

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 SCHEMBL22345157 0.91 ALDH1A1 (0.54) ALDH1A1FKBP5MAOAMAOBMEN1
Imidazole SCHEMBL1702259 0.81
Imidazole SCHEMBL9151381 0.81 ALDH1A1 (0.68) ALDH1A1FKBP5
Imidazole SCHEMBL1827078 0.81 ALDH1A1 (0.68) ALDH1A1FKBP5
Toluene SCHEMBL28135825 0.79 ALDH1A1 (0.45) ALDH1A1FKBP5MEN1KMT2AMAPT
Anthrone SCHEMBL28255329 0.78 MAOA (0.60) ALDH1A1FKBP5MAOAMAOBMEN1
Athraquinones A SCHEMBL28835093 0.77 MAPT (0.67) ALDH1A1MAOAMAOBMEN1KMT2A
Anthraquinone SCHEMBL27476680 0.77 MEN1 (0.71) ALDH1A1MAOAMAOBMEN1KMT2A
Naphthoquinone SCHEMBL20603053 0.77 CDC25B (0.54) ALDH1A1FKBP5MAOAMAOBMEN1
Phthalimide SCHEMBL15948306 0.77 GSK3B (0.58) ALDH1A1FKBP5MAOAMAOBMAPT

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-110684493-A Epoxy adhesive for flexible screen packaging 深圳飞世尔新材料股份有限公司 2020-01-14 CN claimed
CN-110684493-A Epoxy adhesive for flexible screen packaging 深圳飞世尔新材料股份有限公司 2020-01-14 CN disclosed