Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL2114530

Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NCCc1ccccn1.O=C(O)C(F)(F)F

nearest known ligand 0.66

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKAA1 Q13131 7/20 0.66
PRKAA2 P54646 6/20 0.66
KDR P35968 9/20 0.65
TLK2 Q86UE8 3/20 0.65
PDGFRB P09619 11/20 0.64
FGFR1 P11362 6/20 0.64
HDAC3 O15379 5/20 0.63
HDAC4 P56524 5/20 0.63
HDAC1 Q13547 5/20 0.63
HDAC7 Q8WUI4 5/20 0.63
HDAC2 Q92769 5/20 0.63
HDAC10 Q969S8 5/20 0.63
HDAC11 Q96DB2 5/20 0.63
HDAC8 Q9BY41 5/20 0.63
HDAC6 Q9UBN7 5/20 0.63
HDAC9 Q9UKV0 5/20 0.63
HDAC5 Q9UQL6 5/20 0.63
PLK4 O00444 2/20 0.62
DCLK1 O15075 2/20 0.62
PDPK1 O15530 2/20 0.62

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
SCHEMBL13755270 0.95 PRKAA1 (0.72) PRKAA1PRKAA2KDRTLK2PDGFRB
Trifluoroacetic Acid SCHEMBL2115583 0.92 PDGFRB (0.61) PRKAA1PRKAA2KDRTLK2PDGFRB
SCHEMBL13755273 0.86 KDR (0.68) PRKAA1PRKAA2KDRTLK2PDGFRB
SCHEMBL13755271 0.86 KDR (0.68) PRKAA1PRKAA2KDRTLK2PDGFRB
SCHEMBL13755272 0.86 KDR (0.68) PRKAA1PRKAA2KDRTLK2PDGFRB
Trifluoroacetic Acid SCHEMBL29281305 0.85 PRKAA1 (0.90) PRKAA1PRKAA2KDRTLK2PDGFRB
Hydrochloric Acid SCHEMBL31672473 0.85 KDR (0.67) PRKAA1PRKAA2KDRTLK2PDGFRB
Hydrochloric Acid SCHEMBL2115104 0.85 KDR (0.67) PRKAA1PRKAA2KDRTLK2PDGFRB
SCHEMBL13762214 0.84 KDR (0.69) PRKAA1PRKAA2KDRTLK2PDGFRB
SCHEMBL4018724 0.81 PDGFRB (0.83) PRKAA1PRKAA2KDRTLK2PDGFRB

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
US-20120094998-A1 Oligomer-Protein Tyrosine Kinase Inhibitor Conjugates NEKTAR THERAPEUTICS (US) 2012-04-19 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120094998-A1 Oligomer-Protein Tyrosine Kinase Inhibitor Conjugates PTK2B, ERBB2, FRK PRKAA1 881/4885PRKAA2 917/4885KDR 395/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.