Phenylacetic Acid

Phenylacetic Acid

SCHEMBL29278083

O=C(O)Cc1ccccc1.OCCc1ccccc1

nearest known ligand 0.74

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AKR1B1 P15121 1/20 0.74
▸ TDP1 Q9NUW8 1/20 0.70
▸ ABCC4 O15439 1/20 0.57
▸ LMNA P02545 1/20 0.57
▸ GAA P10253 1/20 0.57
▸ TSHR P16473 1/20 0.57
▸ PTGS1 P23219 1/20 0.57
▸ HTT P42858 1/20 0.57
▸ KEAP1 Q14145 1/20 0.56
▸ CES2 O00748 1/20 0.54
▸ CES1 P23141 1/20 0.54
▸ FFAR1 O14842 2/20 0.52
▸ HDAC3 O15379 1/20 0.52
▸ MAPK1 P28482 1/20 0.52
▸ ADRA1A P35348 1/20 0.52
▸ HDAC4 P56524 1/20 0.52
▸ SLC6A3 Q01959 1/20 0.52
▸ HDAC1 Q13547 1/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ HDAC7 Q8WUI4 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
SCHEMBL23501410 0.91 ALDH1A1 (0.61) AKR1B1TDP1ABCC4LMNAGAA
Phenylacetic Acid SCHEMBL27486045 0.89 AKR1B1 (0.85) AKR1B1TDP1ABCC4LMNAGAA
SCHEMBL3961745 0.86 AKR1B1 (0.81) AKR1B1TDP1ABCC4LMNAGAA
Phenylacetic Acid SCHEMBL28242469 0.86 AKR1B1 (1.00) AKR1B1ABCC4LMNAGAATSHR
Phenylacetic Acid SCHEMBL1459 0.86 AKR1B1 (1.00) AKR1B1ABCC4LMNAGAATSHR
Phenylacetic Acid SCHEMBL27758886 0.86 AKR1B1 (1.00) AKR1B1ABCC4LMNAGAATSHR
Phenylacetic Acid SCHEMBL13618842 0.86 AKR1B1 (1.00) AKR1B1ABCC4LMNAGAATSHR
Phenylacetic Acid SCHEMBL1330777 0.86 AKR1B1 (1.00) AKR1B1ABCC4LMNAGAATSHR
Phenylacetic Acid SCHEMBL9449909 0.86 AKR1B1 (1.00) AKR1B1ABCC4LMNAGAATSHR
Phenylacetic Acid SCHEMBL2208559 0.84 AKR1B1 (0.94) AKR1B1ABCC4LMNAGAATSHR

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-115044322-B Packaging adhesive film for HJT and preparation method thereof 浙江帝龙光电材料有限公司 2024-01-16 — — CN disclosed
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