Naphthoquinone

Naphthoquinone

SCHEMBL27601003

O=C1C=CC(=O)c2ccccc21.O=S(=O)(O)O

nearest known ligand 0.74

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

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

The experimentally established mechanism targets of Naphthoquinone. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA known ✓ P21397 4/20 0.74
MAOB known ✓ P27338 2/20 0.74
MAP2K1 known ✓ Q02750 1/20 0.74
IDO1 P14902 6/20 0.74
CDC25B P30305 6/20 0.74
PIN1 Q13526 2/20 0.74
EHMT2 Q96KQ7 2/20 0.74
SNCA P37840 2/20 0.74
AKT1 P31749 1/20 0.74
NSD1 Q96L73 1/20 0.74
EHMT1 Q9H9B1 1/20 0.74
MEN1 O00255 8/20 0.50
KMT2A Q03164 8/20 0.50
MAPT P10636 8/20 0.50
ALDH1A1 P00352 7/20 0.50
RECQL P46063 4/20 0.50
KDM4E B2RXH2 4/20 0.50
THRB P10828 4/20 0.50
HPGD P15428 4/20 0.50
LMNA P02545 3/20 0.50

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
Naphthoquinone SCHEMBL8156846 0.97 IDO1 (0.70) IDO1CDC25BMAOAPIN1EHMT2
Naphthoquinone SCHEMBL5157263 0.97 IDO1 (0.70) IDO1CDC25BMAOAPIN1EHMT2
Naphthoquinone SCHEMBL27583560 0.89 CDC25B (0.58) IDO1CDC25BMAOAPIN1EHMT2
Naphthoquinone SCHEMBL14765271 0.88 CDC25B (0.64) IDO1CDC25BMAOAPIN1EHMT2
Naphthoquinone SCHEMBL14764076 0.88 CDC25B (0.64) IDO1CDC25BMAOAPIN1EHMT2
Naphthoquinone SCHEMBL27749420 0.86 CDC25B (0.61) IDO1CDC25BMAOAPIN1EHMT2
Naphthoquinone SCHEMBL29148131 0.86 CDC25B (0.61) IDO1CDC25BMAOAPIN1EHMT2
Naphthoquinone SCHEMBL29354680 0.86 IDO1 (1.00) IDO1CDC25BMAOAPIN1EHMT2
Naphthoquinone SCHEMBL11359780 0.86 IDO1 (1.00) IDO1CDC25BMAOAPIN1EHMT2
Naphthoquinone SCHEMBL42139 0.86 IDO1 (1.00) IDO1CDC25BMAOAPIN1EHMT2

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-1501167-A Radiation-sensitive resin composition 住友化学工业株式会社 2004-06-02 CN disclosed