Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL8435341

O=C(CN1CCCNCC1)OCc1ccc([N+](=O)[O-])cc1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KCNJ1 P48048 2/20 0.48
KCNH2 Q12809 1/20 0.47
ALDH1A1 P00352 3/20 0.46
MAPT P10636 2/20 0.46
KDM4E B2RXH2 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.39

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
SCHEMBL9124661 0.94 KCNJ1 (0.53) KCNJ1KCNH2ALDH1A1MAPTKDM4E
SCHEMBL9126753 0.89 KCNJ1 (0.58) KCNJ1KCNH2ALDH1A1MAPTKDM4E
Trifluoroacetic Acid SCHEMBL8440377 0.86 KDM4E (0.53) KCNJ1KCNH2ALDH1A1MAPTKDM4E
SCHEMBL14312197 0.86 ALDH1A1 (0.53) ALDH1A1MAPTKDM4ETDP1LMNA
SCHEMBL14477660 0.85 KCNJ1 (0.58) KCNJ1KCNH2ALDH1A1MAPTKDM4E
SCHEMBL14312170 0.85 KCNJ1 (0.58) KCNJ1KCNH2ALDH1A1MAPTKDM4E
Trifluoroacetic Acid SCHEMBL8438033 0.84 KCNJ1 (0.47) KCNJ1KCNH2ALDH1A1MAPTKDM4E
SCHEMBL7169664 0.83 LMNA (0.52) KCNJ1KCNH2ALDH1A1MAPTLMNA
SCHEMBL14477659 0.82 KCNJ1 (0.54) KCNJ1KCNH2ALDH1A1MAPTKDM4E
Trifluoroacetic Acid SCHEMBL6046649 0.80 KCNJ1 (0.48) KCNJ1KCNH2ALDH1A1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5866564-A STABILITY SANKYO COMPANY, LIMITED (JP) 1999-02-02 US disclosed
EP-0518558-B1 1-Methylcarbapenem derivatives, their preparation and their use as antibiotics SANKYO CO (JP) 1998-09-02 EP disclosed
US-5712267-A Carbapenem derivatives, their preparation and their use as antibiotics SANKYO COMPANY,. LIMITED (JP) 1998-01-27 US disclosed
EP-0518558-A1 1-Methylcarbapenem derivatives, their preparation and their use as antibiotics Sankyo Company Limited (JP) 1992-12-16 EP disclosed