Phenyl Propionic Acid

Phenyl Propionic Acid

SCHEMBL29282176

O=C(O)CCc1cccc(O)c1.O=C(O)CCc1ccccc1

nearest known ligand 0.70

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.70
FFAR1 O14842 8/20 0.66
OPRK1 P41145 4/20 0.61
OPRM1 P35372 3/20 0.56
OPRD1 P41143 3/20 0.56
FFAR4 Q5NUL3 2/20 0.56
PTPRB P23467 1/20 0.56
CDC25A P30304 1/20 0.56
CDC25B P30305 1/20 0.56
PTEN P60484 1/20 0.56
PTPMT1 Q8WUK0 1/20 0.56
PLA2G4A P47712 1/20 0.55
IDO1 P14902 1/20 0.55
HDAC3 O15379 1/20 0.55
MAPK1 P28482 1/20 0.55
ADRA1A P35348 1/20 0.55
HDAC4 P56524 1/20 0.55
SLC6A3 Q01959 1/20 0.55
HDAC1 Q13547 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55

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
SCHEMBL29563859 0.96 KEAP1 (0.63) KEAP1FFAR1OPRK1OPRM1OPRD1
SCHEMBL65250 0.96 KEAP1 (0.63) KEAP1FFAR1OPRK1OPRM1OPRD1
SCHEMBL31336237 0.96 KEAP1 (0.63) KEAP1FFAR1OPRK1OPRM1OPRD1
SCHEMBL30825091 0.89 FFAR1 (0.56) KEAP1FFAR1OPRK1FFAR4PTPRB
SCHEMBL29185406 0.89 FFAR1 (0.56) KEAP1FFAR1OPRK1FFAR4PTPRB
Sulfuric Acid SCHEMBL18729778 0.89 FFAR1 (0.55) KEAP1FFAR1OPRK1FFAR4PTPRB
Phenyl Propionic Acid SCHEMBL27725915 0.88 KEAP1 (0.83) KEAP1FFAR1FFAR4HDAC3MAPK1
SCHEMBL8435278 0.86 FFAR1 (0.80) KEAP1FFAR1FFAR4PTPRBCDC25A
Phenyl Propionic Acid SCHEMBL29011742 0.86 KEAP1 (0.79) KEAP1FFAR1FFAR4HDAC3MAPK1
SCHEMBL3717612 0.85 HDAC6 (0.66) KEAP1FFAR1OPRK1IDO1HDAC3

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-117987431-A Application of knock-out mhpA gene in improving L-phenylalanine yield 河南省健康元生物医药研究院有限公司 2024-05-07 CN disclosed