Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL8165236

NCCC[C@@H](COc1ccc2ccccc2c1)NC(=O)[C@@H](N)Cc1ccccc1.O=C(O)C(F)(F)F

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MC4R P32245 3/20 0.43
MC3R P41968 3/20 0.43
PTPN1 P18031 1/20 0.41
PPARG P37231 5/20 0.40
PPARA Q07869 4/20 0.40
PPARD Q03181 3/20 0.40
MC5R P33032 2/20 0.40
LTA4H P09960 1/20 0.40
ITGB3 P05106 2/20 0.39
ITGA2B P08514 2/20 0.39
CTSC P53634 1/20 0.39
MMP2 P08253 1/20 0.39
ERAP2 Q6P179 1/20 0.38
LNPEP Q9UIQ6 1/20 0.38
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
KMT2A Q03164 1/20 0.38
NCOA2 Q15596 1/20 0.38
NCOA1 Q15788 1/20 0.38
NCOA3 Q9Y6Q9 1/20 0.38

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 SCHEMBL8170100 0.93 LTA4H (0.41) MC4RMC3RPTPN1PPARGPPARA
Trifluoroacetic Acid SCHEMBL8163599 0.93 LTA4H (0.44) MC4RMC3RPTPN1PPARGPPARA
Trifluoroacetic Acid SCHEMBL8165238 0.89 MC4R (0.43) MC4RMC3RPTPN1PPARGPPARA
Trifluoroacetic Acid SCHEMBL8163602 0.84 MMP2 (0.42) MC4RMC3RPPARGPPARAMC5R
Trifluoroacetic Acid SCHEMBL7860829 0.83 LNPEP (0.44) MC4RMC3RPPARGPPARAMC5R
Trifluoroacetic Acid SCHEMBL8174490 0.81 MC4R (0.44) MC4RMC3RMC5RCTSCMMP2
Trifluoroacetic Acid SCHEMBL7860786 0.79 KDM4E (0.43) PPARGPPARALTA4HITGB3ITGA2B
SCHEMBL8170011 0.78 ERAP2 (0.40) MC4RMC3RPPARGPPARAMC5R
Trifluoroacetic Acid SCHEMBL7860864 0.78 ERAP2 (0.42) MC4RMC3RMC5RCTSCMMP2
SCHEMBL7860762 0.77 LNPEP (0.47) MC4RMC3RPPARGPPARAMC5R

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
US-6114310-A THERAPY FOR MICROBIAL INFECTIONS MICROCIDE PHARMACEUTICALS, INC. (US) 2000-09-05 US disclosed