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Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL20141710

Cc1cc(C)c(C(=O)N2CCN(c3ccc4cc[nH]c4c3)C[C@@H]2C)cc1CN1CCN(c2ccccc2C#N)CC1.O=C(O)C(F)(F)F

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MTOR P42345 2/20 0.43
▸ RPTOR Q8N122 2/20 0.43
▸ MLST8 Q9BVC4 2/20 0.43
▸ CHRM4 P08173 6/20 0.42
▸ CHRM2 P08172 10/20 0.41
▸ CHRM1 P11229 7/20 0.41
▸ CHRM5 P08912 3/20 0.41
▸ GHSR Q92847 2/20 0.40
▸ CHRM3 P20309 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 SCHEMBL20140974 0.96 CHRM4 (0.42) MTORRPTORMLST8CHRM4CHRM2
Trifluoroacetic Acid SCHEMBL20140975 0.96 CHRM4 (0.42) MTORRPTORMLST8CHRM4CHRM2
SCHEMBL20156947 0.95 MTOR (0.45) MTORRPTORMLST8CHRM4CHRM2
SCHEMBL20156829 0.91 MTOR (0.43) MTORRPTORMLST8CHRM4CHRM2
SCHEMBL20156948 0.84 MTOR (0.51) MTORRPTORMLST8
SCHEMBL20141016 0.83 MTOR (0.53) MTORRPTORMLST8CHRM4CHRM2
SCHEMBL20142001 0.83 MTOR (0.47) MTORRPTORMLST8CHRM4
SCHEMBL20142004 0.83 MTOR (0.47) MTORRPTORMLST8CHRM4
SCHEMBL20140677 0.81 CHRM1 (0.38) MTORRPTORMLST8CHRM4CHRM2
SCHEMBL20141592 0.80 MTOR (0.43) MTORRPTORMLST8CHRM4CHRM2

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-2018089433-A1 PHENYL mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. (US) 2018-05-17 — — WO disclosed