Alpha-Naphthylacetate

Alpha-Naphthylacetate

SCHEMBL28109043

CC(=O)Oc1cccc2ccccc12.CC(=O)Oc1cccc2ccccc12.N

nearest known ligand 0.64

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.64
▸ HSD17B10 Q99714 4/20 0.64
▸ PTGS1 P23219 2/20 0.64
▸ GAA P10253 2/20 0.64
▸ PGR P06401 1/20 0.64
▸ MAPK1 P28482 1/20 0.64
▸ KMT2A Q03164 3/20 0.57
▸ L3MBTL1 Q9Y468 2/20 0.57
▸ MEN1 O00255 1/20 0.57
▸ RAB9A P51151 1/20 0.57
▸ MMP2 P08253 1/20 0.54
▸ KDM4E B2RXH2 5/20 0.53
▸ HPGD P15428 3/20 0.52
▸ TDP1 Q9NUW8 3/20 0.52
▸ TSHR P16473 2/20 0.52
▸ BLM P54132 2/20 0.52
▸ ESR1 P03372 1/20 0.52
▸ ITGB3 P05106 1/20 0.52
▸ ITGA2B P08514 1/20 0.52
▸ HMGB1 P09429 1/20 0.52

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
Alpha-Naphthylacetate SCHEMBL27862836 1.00 ALDH1A1 (0.64) ALDH1A1HSD17B10PTGS1GAAPGR
Alpha-Naphthylacetate SCHEMBL29372782 0.98 ALDH1A1 (0.66) ALDH1A1HSD17B10PTGS1GAAPGR
Alpha-Naphthylacetate SCHEMBL76633 0.98 ALDH1A1 (0.66) ALDH1A1HSD17B10PTGS1GAAPGR
Alpha-Naphthylacetate SCHEMBL28643889 0.96 ALDH1A1 (0.64) ALDH1A1HSD17B10PTGS1GAAPGR
Alpha-Naphthylacetate SCHEMBL11320989 0.96 ALDH1A1 (0.64) ALDH1A1HSD17B10PTGS1GAAPGR
Alpha-Naphthylacetate SCHEMBL14715892 0.96 ALDH1A1 (0.64) ALDH1A1HSD17B10PTGS1GAAPGR
Alpha-Naphthylacetate SCHEMBL10751537 0.96 ALDH1A1 (0.64) ALDH1A1HSD17B10PTGS1GAAPGR
Alpha-Naphthylacetate SCHEMBL10751544 0.96 ALDH1A1 (0.64) ALDH1A1HSD17B10PTGS1GAAPGR
Alpha-Naphthylacetate SCHEMBL14715880 0.96 ALDH1A1 (0.64) ALDH1A1HSD17B10PTGS1GAAPGR
Alpha-Naphthylacetate SCHEMBL14715837 0.96 ALDH1A1 (0.64) ALDH1A1HSD17B10PTGS1GAAPGR

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-106106451-A A kind of plant establishment compositions, preparation and application thereof for foliage-spray 四川国光农化股份有限公司 2016-11-16 — — CN disclosed
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