Anthraquinone

Anthraquinone

SCHEMBL8910423

C=CCc1ccccc1Nc1ccc(Nc2ccccc2CC=C)c2c1C(=O)c1ccccc1C2=O.O=C1c2ccccc2C(=O)c2ccccc21

nearest known ligand 0.45

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 3/20 0.45
▸ P2RY4 P51582 3/20 0.43
▸ P2RY2 P41231 2/20 0.43
▸ MAPK1 P28482 3/20 0.41
▸ RAB9A P51151 3/20 0.41
▸ L3MBTL1 Q9Y468 3/20 0.41
▸ MAPT P10636 2/20 0.41
▸ TDP1 Q9NUW8 2/20 0.41
▸ EGFR P00533 1/20 0.41
▸ PABPC1 P11940 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ ADRA2B P18089 1/20 0.39
▸ ADRA2C P18825 1/20 0.39
▸ GNG2 P59768 1/20 0.39
▸ GNB1 P62873 1/20 0.39
▸ HIF1A Q16665 1/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ NSD2 O96028 2/20 0.39
▸ POLB P06746 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
SCHEMBL8551947 0.98 P2RY4 (0.44) CYP1A2P2RY4P2RY2MAPK1RAB9A
SCHEMBL1906939 0.85 GABRA1 (0.42) CYP1A2P2RY4P2RY2MAPK1RAB9A
SCHEMBL10761705 0.83 CYP1A2 (0.50) CYP1A2P2RY4P2RY2MAPK1RAB9A
SCHEMBL8089156 0.83 MAPT (0.49) CYP1A2MAPK1RAB9AL3MBTL1MAPT
SCHEMBL176287 0.80 ADRA2C (0.47) CYP1A2MAPK1RAB9AL3MBTL1MAPT
SCHEMBL11575989 0.80 P2RY12 (0.46) CYP1A2P2RY4P2RY2MAPK1RAB9A
SCHEMBL14860870 0.80 P2RY2 (0.61) CYP1A2P2RY4P2RY2MAPK1RAB9A
SCHEMBL13370366 0.79 P2RY2 (0.39) CYP1A2P2RY4P2RY2MAPK1RAB9A
SCHEMBL175397 0.78 GABRA1 (0.50) CYP1A2MAPK1RAB9AL3MBTL1MAPT
SCHEMBL38652483 0.78 GABRA1 (0.50) CYP1A2MAPK1RAB9AL3MBTL1MAPT

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
US-5603735-A WHICH FORM STABLE MICRODISPERSIONS IN WATER; COLORFASTNESS MORTON INTERNATIONAL, INC. (US) 1997-02-18 — — US claimed
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