Phenylacetylene

Phenylacetylene

SCHEMBL7892240

C#Cc1ccccc1.[Co].[Co]

nearest known ligand 0.65

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 1/20 0.50
▸ HDAC8 Q9BY41 3/20 0.48
▸ TSHR P16473 1/20 0.45
▸ CYP2C9 P11712 3/20 0.39
▸ CA12 O43570 2/20 0.39
▸ CA1 P00915 2/20 0.39
▸ CA2 P00918 2/20 0.39
▸ CA9 Q16790 2/20 0.39
▸ CA14 Q9ULX7 2/20 0.39
▸ CYP1A1 P04798 1/20 0.39
▸ CYP1B1 Q16678 1/20 0.39
▸ CA4 P22748 1/20 0.39
▸ MAPT P10636 1/20 0.38
▸ PTPN1 P18031 2/20 0.37
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ THPO P40225 1/20 0.36
▸ BLM P54132 1/20 0.35
▸ PMP22 Q01453 1/20 0.35

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
Phenylacetylene SCHEMBL28122451 1.00 — —
Phenylacetylene SCHEMBL27795197 0.97 APP (0.53) APPHDAC8TSHRCYP2C9CA12
Phenylacetylene SCHEMBL6891916 0.97 APP (0.53) APPHDAC8TSHRCYP2C9CA12
Phenylacetylene SCHEMBL1331558 0.97 — —
Phenylacetylene SCHEMBL4297769 0.97 — —
Phenylacetylene SCHEMBL1331398 0.97 — —
Phenylacetylene SCHEMBL4884 0.97 — —
Phenylacetylene SCHEMBL1331408 0.97 — —
Phenylacetylene SCHEMBL23273254 0.93 — —
Phenylacetylene SCHEMBL10421188 0.93 — —

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6174840-B1 CONTROLLING PLANT GROWTH BY USING FUSED CYCLOPENTANONES DERIVATIVES AND CYCLOPENTENONES COMPOUNDS; CONTROLLING TRANSPIRATION AND SHOOT GROWTH THE UNIVERSITY OF STRATHCLYDE (GB) 2001-01-16 — — US disclosed
WO-1994012029-A1 USE OF FUSED RING CYCLOPENTANONES AND CYCLOPENTENONES IN CONTROLLING PLANT GROWTH BRITISH TECHNOLOGY GROUP LIMITED (GB) 1994-06-09 — — WO disclosed
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