Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL2553047

O=C(O)C(F)(F)F.O=C(O)C(c1ccccc1)N1CCCC1

nearest known ligand 0.78

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.78
GAA P10253 1/20 0.76
ALDH1A1 P00352 4/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
TSHR P16473 1/20 0.50
KDM4E B2RXH2 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.46
CYP1A2 P05177 3/20 0.46
CYP3A4 P08684 3/20 0.46
CYP2D6 P10635 3/20 0.46
CYP2C9 P11712 3/20 0.46
KCNA5 P22460 3/20 0.46
CYP2C19 P33261 3/20 0.46
KCNH2 Q12809 3/20 0.46
CHRM2 P08172 2/20 0.45
CHRM1 P11229 2/20 0.45
CHRM3 P20309 2/20 0.45
CHRM4 P08173 1/20 0.45
CHRM5 P08912 1/20 0.45

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
SCHEMBL628330 0.90 LMNA (0.96) LMNAGAAALDH1A1MEN1KMT2A
SCHEMBL2227113 0.90 LMNA (0.96) LMNAGAAALDH1A1MEN1KMT2A
SCHEMBL15063248 0.88 GAA (0.96) LMNAGAAALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL15063253 0.88 LMNA (1.00) LMNAGAAALDH1A1MEN1KMT2A
SCHEMBL2554530 0.88 GAA (0.96) LMNAGAAALDH1A1MEN1KMT2A
SCHEMBL1808956 0.88 GAA (0.96) LMNAGAAALDH1A1MEN1KMT2A
SCHEMBL628011 0.88 GAA (0.96) LMNAGAAALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL2988022 0.86 GAA (1.00) LMNAGAAALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL629184 0.86 GAA (1.00) LMNAGAAALDH1A1MEN1KMT2A
SCHEMBL18061849 0.86 LMNA (0.89) LMNAGAAALDH1A1MEN1KMT2A

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
WO-2011123937-A1 KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME UNIVERSITY HEALTH NETWORK (CA) 2011-10-13 WO disclosed