Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5208291

Cc1cccc(N(CC(=O)O)C(=O)c2cccc(CN)c2)n1.NC(=O)c1nc2c(s1)CCCC2.O=C(O)C(F)(F)F

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.33
TP53 P04637 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
NPC1 O15118 1/20 0.32
PKM P14618 1/20 0.32
RAB9A P51151 1/20 0.32
F2 P00734 3/20 0.31
TPSAB1 Q15661 1/20 0.31
LMNA P02545 1/20 0.30
USP28 Q96RU2 1/20 0.30
USP25 Q9UHP3 1/20 0.30

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 SCHEMBL5206023 0.85 ENPP2 (0.36)
Trifluoroacetic Acid SCHEMBL5211197 0.85 FLT3 (0.36) MAPTTP53NPC1RAB9A
Trifluoroacetic Acid SCHEMBL5203620 0.85 PIK3CA (0.33) MAPTTP53SMN1; SMN2NPC1PKM
SCHEMBL5210132 0.83 F2 (0.39) MAPTTP53SMN1; SMN2NPC1PKM
Trifluoroacetic Acid SCHEMBL5208294 0.83 MEN1 (0.31)
Trifluoroacetic Acid SCHEMBL5208796 0.83 SMN1; SMN2 (0.35) MAPTSMN1; SMN2NPC1RAB9ALMNA
Trifluoroacetic Acid SCHEMBL5209196 0.82 IKBKB (0.33) F2
Trifluoroacetic Acid SCHEMBL5209741 0.82 PDE4D (0.38) MAPTTP53LMNA
SCHEMBL6991435 0.80 F2 (0.35) MAPTTP53SMN1; SMN2NPC1PKM
Hydrochloric Acid SCHEMBL5208877 0.79 PIK3CA (0.35) MAPTTP53SMN1; SMN2NPC1PKM

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
EP-1343561-B1 SERINE PROTEASE INHIBITORS TULARIK LTD (GB) 2007-02-28 EP disclosed