Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5210994

NC(=O)c1sc2c(c1C(=O)NCc1ccco1)CCCC2.NCc1cccc(C(=O)N(CC(=O)O)c2ccccc2)c1.O=C(O)C(F)(F)F

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.43
POLB P06746 4/20 0.43
THRB P10828 1/20 0.43
ALDH1A1 P00352 11/20 0.42
HPGD P15428 6/20 0.42
KDM4E B2RXH2 6/20 0.42
GAA P10253 5/20 0.42
NPSR1 Q6W5P4 2/20 0.42
SAE1 Q9UBE0 1/20 0.42
UBA2 Q9UBT2 1/20 0.42
TSHR P16473 4/20 0.42
HSD17B10 Q99714 3/20 0.42
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
USP2 O75604 2/20 0.41
ALOX15 P16050 1/20 0.41
CASP1 P29466 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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 SCHEMBL5207372 0.92 RORC (0.47) MAPTKMT2ARAB9ARORC
Trifluoroacetic Acid SCHEMBL5204002 0.87 FLT3 (0.38) MAPTPOLBALDH1A1KDM4ENPSR1
Trifluoroacetic Acid SCHEMBL5204823 0.87 AMY1A (0.48) MAPTPOLBALDH1A1HPGDKDM4E
Trifluoroacetic Acid SCHEMBL5209718 0.87 FLT3 (0.39) MAPTPOLBALDH1A1HPGDKDM4E
Trifluoroacetic Acid SCHEMBL5205660 0.87 RORC (0.38) MAPTALDH1A1KDM4EHSD17B10MEN1
Trifluoroacetic Acid SCHEMBL5205740 0.87 RORC (0.38) MAPTPOLBALDH1A1NPSR1MEN1
Trifluoroacetic Acid SCHEMBL5211954 0.86 FLT3 (0.37) MAPTPOLBALDH1A1HPGDKDM4E
Trifluoroacetic Acid SCHEMBL5280152 0.84 ALDH1A1 (0.40) MAPTALDH1A1HPGDKDM4EMEN1
Trifluoroacetic Acid SCHEMBL5208332 0.84 FLT3 (0.35) MAPTPOLBALDH1A1HPGDKDM4E
Trifluoroacetic Acid SCHEMBL5628234 0.83 ALDH1A1 (0.38) MAPTALDH1A1HPGDKDM4EGAA

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
EP-1343561-B1 SERINE PROTEASE INHIBITORS TULARIK LTD (GB) 2007-02-28 EP disclosed