Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6775615

CC(=N)N1CCC(Oc2ccc(C(=O)NCCCOc3ccc4ccnc(N)c4c3)cc2)CC1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
F10 P00742 11/20 0.60
F2 P00734 3/20 0.53
MAPT P10636 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
OPRM1 P35372 2/20 0.41
OPRD1 P41143 2/20 0.41
LMNA P02545 1/20 0.41
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40

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 SCHEMBL6770954 0.98 F10 (0.63) F10F2MAPTL3MBTL1KMT2A
Trifluoroacetic Acid SCHEMBL6771038 0.87 ROCK1 (0.48) F10F2OPRM1OPRD1LMNA
Trifluoroacetic Acid SCHEMBL6765933 0.86 F10 (0.68) F10F2MAPTL3MBTL1KMT2A
Trifluoroacetic Acid SCHEMBL6771145 0.84 ROCK1 (0.48) F10F2
Trifluoroacetic Acid SCHEMBL6769129 0.83 F10 (0.53) F10F2L3MBTL1KMT2AMEN1
Trifluoroacetic Acid SCHEMBL3910305 0.81 F10 (0.90) F10F2
Trifluoroacetic Acid SCHEMBL6765882 0.80 F10 (0.56) F10F2KMT2AMEN1ALDH1A1
Trifluoroacetic Acid SCHEMBL6775232 0.80 RAD52 (0.42) F10MAPTL3MBTL1ALDH1A1
Trifluoroacetic Acid SCHEMBL6775993 0.78 F10 (0.42) F10L3MBTL1ALDH1A1
Trifluoroacetic Acid SCHEMBL6770182 0.77 NPC1 (0.42) F10L3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6825181-B1 ORALLY ADMINISTRATED TO EXHIBIT A STRONG ANTICOAGULANT EFFECT BY INHIBITING ACTIVATED BLOOD- COAGULATION FACTOR X AJINOMOTO CO., INC. (JP) 2004-11-30 US disclosed
EP-1065200-A1 AMINOISOQUINOLINE DERIVATIVES Ajinomoto Co., Inc. (JP) 2001-01-03 EP disclosed