Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5657613

COc1ccc(CC(N)=O)cc1Br.O=C(O)C(F)(F)F

nearest known ligand 0.51

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.51
RIN1 Q13671 1/20 0.51
HDAC1 Q13547 7/20 0.49
HDAC6 Q9UBN7 4/20 0.49
ALDH1A1 P00352 4/20 0.47
GAA P10253 2/20 0.47
LMNA P02545 1/20 0.47
MEN1 O00255 2/20 0.46
KDM4E B2RXH2 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
RNASEH1 O60930 1/20 0.44
MAPT P10636 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL2734577 0.90 ABL1 (0.59) ABL1RIN1HDAC1HDAC6ALDH1A1
Trifluoroacetic Acid SCHEMBL6424557 0.89 LDHA (0.53) ABL1RIN1ALDH1A1GAALMNA
SCHEMBL138449 0.79 GAA (0.68) ABL1RIN1HDAC1HDAC6ALDH1A1
Trifluoroacetic Acid SCHEMBL5658221 0.78 KDM4E (0.48) ALDH1A1GAALMNAMEN1KDM4E
SCHEMBL1033641 0.77 LMNA (0.61) ABL1RIN1ALDH1A1GAALMNA
SCHEMBL29602721 0.77 LMNA (0.61) ABL1RIN1ALDH1A1GAALMNA
SCHEMBL17653947 0.77 ALDH1A1 (0.45) ABL1RIN1ALDH1A1GAALMNA
Trifluoroacetic Acid SCHEMBL5655817 0.77 HTT (0.51) ALDH1A1
SCHEMBL2853330 0.76 HDAC1 (0.58) ABL1RIN1HDAC1HDAC6ALDH1A1
SCHEMBL21916942 0.76 HDAC1 (0.54) ABL1RIN1HDAC1HDAC6ALDH1A1

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-7309701-B2 Pyridazinone derivatives as pharmaceuticals and pharmaceutical compositions containing them SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-12-18 US disclosed