Phenylacetic Acid

Phenylacetic Acid

SCHEMBL28201036

O=C(O)Cc1ccccc1.[La]

nearest known ligand 0.94

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AKR1B1 P15121 2/20 0.94
▸ ABCC4 O15439 1/20 0.70
▸ LMNA P02545 1/20 0.70
▸ GAA P10253 1/20 0.70
▸ TSHR P16473 1/20 0.70
▸ PTGS1 P23219 1/20 0.70
▸ HTT P42858 1/20 0.70
▸ CES1 P23141 2/20 0.67
▸ CES2 O00748 1/20 0.67
▸ FFAR1 O14842 1/20 0.61
▸ CA2 P00918 1/20 0.61
▸ CAMK2A Q9UQM7 1/20 0.61
▸ MEN1 O00255 1/20 0.56
▸ KMT2A Q03164 1/20 0.56
▸ HDAC8 Q9BY41 1/20 0.56
▸ HDAC6 Q9UBN7 1/20 0.56
▸ PAM P19021 2/20 0.56
▸ NAPRT Q6XQN6 1/20 0.56
▸ KEAP1 Q14145 1/20 0.54
▸ FNTA P49354 1/20 0.54

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
Phenylacetic Acid SCHEMBL28242469 0.97 AKR1B1 (1.00) AKR1B1ABCC4LMNAGAATSHR
Phenylacetic Acid SCHEMBL27758886 0.97 AKR1B1 (1.00) AKR1B1ABCC4LMNAGAATSHR
Phenylacetic Acid SCHEMBL9449909 0.97 AKR1B1 (1.00) AKR1B1ABCC4LMNAGAATSHR
Phenylacetic Acid SCHEMBL13618842 0.97 AKR1B1 (1.00) AKR1B1ABCC4LMNAGAATSHR
Phenylacetic Acid SCHEMBL1330777 0.97 AKR1B1 (1.00) AKR1B1ABCC4LMNAGAATSHR
Phenylacetic Acid SCHEMBL1459 0.97 AKR1B1 (1.00) AKR1B1ABCC4LMNAGAATSHR
Phenylacetic Acid SCHEMBL6930087 0.94 AKR1B1 (0.94) AKR1B1ABCC4LMNAGAATSHR
Phenylacetic Acid SCHEMBL7214232 0.94 AKR1B1 (0.94) AKR1B1ABCC4LMNAGAATSHR
Phenylacetic Acid SCHEMBL6547063 0.94 AKR1B1 (0.94) AKR1B1ABCC4LMNAGAATSHR
Phenylacetic Acid SCHEMBL388148 0.94 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112759802-B Low-heat-generation and aging-resistant rubber composition and tire tread 北京彤程创展科技有限公司 2022-08-23 — — CN disclosed
CN-112759802-A Low-heat-generation and aging-resistant rubber composition and tire tread 北京彤程创展科技有限公司 2021-05-07 — — CN disclosed
CN-112480475-A Anti-aging flame-retardant hydraulic rubber tube and preparation method thereof 嘉兴市爵拓科技有限公司 2021-03-12 — — CN disclosed
CN-107652489-A A kind of low zinc rubber composition for tire tread and use its tire tread 北京彤程创展科技有限公司 2018-02-02 — — CN disclosed
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