Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5308392

O=C(O)C(F)(F)F.O=C(O)c1cc(F)cc2c1-c1c(C3CCCCC3)c3ccccc3n1CCNC2

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 3/20 0.38
HTR2C P28335 3/20 0.38
CNR1 P21554 1/20 0.33
TPSAB1 Q15661 3/20 0.33
DHODH Q02127 1/20 0.32
PRKCA P17252 1/20 0.32
MMP12 P39900 1/20 0.32
KDM4E B2RXH2 1/20 0.32
HDAC2 Q92769 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
LIPG Q9Y5X9 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 SCHEMBL3087552 0.77 PRKCA (0.41) PRKCAMMP12
SCHEMBL3088938 0.76 PRKCA (0.40) PRKCAMMP12
SCHEMBL3075589 0.72 PRKCA (0.42) PRKCAMMP12
SCHEMBL878419 0.70 PRKCA (0.49) HTR2AHTR2CCNR1PRKCAMMP12
SCHEMBL3088937 0.66 NR1I2 (0.41) HTR2APRKCAMMP12
SCHEMBL3085163 0.64 SCN9A (0.42) PRKCAMMP12KDM4EHDAC8HDAC6
SCHEMBL3085391 0.63 NR1I2 (0.46) PRKCAMMP12
SCHEMBL804196 0.61 PRKCA (0.51) PRKCAMMP12KDM4E
Trifluoroacetic Acid SCHEMBL18440248 0.60 HTT (0.36)
SCHEMBL5255581 0.60 PRKCA (0.46) PRKCAMMP12

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
EP-1807403-A2 TETRACYCLIC INDOLE DERIVATIVES AS ANTIVIRAL AGENTS Istituto di Richerche di Biologia Molecolare P. Angeletti S.p.A. (IT) 2007-07-18 EP disclosed
WO-2006046030-A2 TETRACYCLIC INDOLE DERIVATIVES AS ANTIVIRAL AGENTS ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P ANGELETTI SPA (IT) 2006-05-04 WO disclosed