Trimethylammonium

Trimethylammonium

SCHEMBL11075798

CN(C)C.C[SiH2]c1ccccc1

nearest known ligand 0.36

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.36
ALDH1A1 P00352 3/20 0.36
KCNN4 O15554 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
HTT P42858 1/20 0.35
MAPT P10636 2/20 0.33
HTR2A P28223 2/20 0.33
HRH1 P35367 2/20 0.33
AOC3 Q16853 2/20 0.33
TAAR1 Q96RJ0 2/20 0.33
LMNA P02545 1/20 0.33
ALOX12 P18054 1/20 0.33
ACHE P22303 1/20 0.33
OPRM1 P35372 1/20 0.33
OPRK1 P41145 1/20 0.33
OPRL1 P41146 1/20 0.33
TDP1 Q9NUW8 2/20 0.32
HSP90AA1 P07900 1/20 0.32
HSD17B10 Q99714 2/20 0.32

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
SCHEMBL67968 0.91
Water SCHEMBL28098685 0.88
Hydrochloric Acid SCHEMBL28181815 0.88
SCHEMBL27968456 0.88
Hydrochloric Acid SCHEMBL7937814 0.88 TSHR (0.37) TSHRALDH1A1MAPTLMNAALOX12
SCHEMBL9718210 0.88 TSHR (0.37) TSHRALDH1A1MAPTLMNAALOX12
Ammonia Solution, Strong SCHEMBL28586237 0.88
Hydrochloric Acid SCHEMBL5702841 0.88 TSHR (0.37) TSHRALDH1A1MAPTLMNAALOX12
Fluoride SCHEMBL29655462 0.88
SCHEMBL28535293 0.85 TSHR (0.36) TSHRALDH1A1MAPTLMNAALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4490538-A Enlarged-hetero-ring prostacyclin analogs THE UPJOHN COMPANY (US) 1984-12-25 US disclosed
US-4490537-A Enlarged-hetero-ring prostacyclin analogs THE UPJOHN COMPANY (US) 1984-12-25 US disclosed
US-4490548-A Enlarged-hetero-ring prostacyclin analogs THE UPJOHN COMPANY (US) 1984-12-25 US disclosed
US-4490549-A Enlarged-hetero-ring prostacyclin analogs THE UPJOHN COMPANY (US) 1984-12-25 US disclosed
US-4058564-A PROSTAGLANDINS; HYPOTENSIVE, LABOR INDUCERS, ANTISECRETORY THE UPJOHN COMPANY (US) 1977-11-15 US disclosed