Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL8521644

CC(C)(N)C(=O)NC(CCCc1ccccc1)C(=O)N1CCC2(CC1)CC(=O)c1ccccc12.O=C(O)C(F)(F)F

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 2/20 0.47
TACR1 P25103 2/20 0.39
HRH3 Q9Y5N1 1/20 0.38
OPRK1 P41145 7/20 0.37
TGM2 P21980 1/20 0.37
OPRM1 P35372 2/20 0.36
SIGMAR1 Q99720 1/20 0.36
CCKBR P32239 2/20 0.36
TACR2 P21452 1/20 0.36
CTSB P07858 1/20 0.35
CTSS P25774 1/20 0.35
CTSK P43235 1/20 0.35
ACE2 Q9BYF1 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
Trifluoroacetic Acid SCHEMBL8521646 1.00 GHSR (0.47) GHSRTACR1HRH3OPRK1TGM2
SCHEMBL2589574 0.96 GHSR (0.50) GHSRTACR1HRH3OPRK1TGM2
SCHEMBL2589571 0.96 GHSR (0.50) GHSRTACR1HRH3OPRK1TGM2
Hydrochloric Acid SCHEMBL8521498 0.95 GHSR (0.49) GHSRTACR1HRH3OPRK1TGM2
Hydrochloric Acid SCHEMBL8521496 0.95 GHSR (0.49) GHSRTACR1HRH3OPRK1TGM2
Trifluoroacetic Acid SCHEMBL8313703 0.87 GHSR (0.44) GHSRHRH3
Trifluoroacetic Acid SCHEMBL8311373 0.87 GHSR (0.44) GHSRHRH3
SCHEMBL8522337 0.83 GHSR (0.40) GHSRTACR1HRH3TGM2SIGMAR1
SCHEMBL8522338 0.83 GHSR (0.40) GHSRTACR1HRH3TGM2SIGMAR1
SCHEMBL5050565 0.82 GHSR (0.68) GHSRTACR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0662481-B1 Spiro piperidines and homologs promote release of growth hormone MERCK & CO INC (US) 1999-03-24 EP disclosed
US-5578593-A RELEASING GROWTH HORMONES FOR ANIMALS MERCK & CO., INC. (US) 1996-11-26 US disclosed
EP-0662481-A1 Spiro piperidines and homologs promote release of growth hormone MERCK & CO. INC. (US) 1995-07-12 EP disclosed