Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7787645

CC(NC(c1cccc(Nc2c(O)c(=O)c2=O)c1)c1cccs1)c1ccc(F)c(F)c1.O=C(O)C(F)(F)F

nearest known ligand 0.36

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Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPKAPK2 P49137 10/20 0.36
CXCR2 P25025 8/20 0.34
MAPK14 Q16539 1/20 0.34
CXCR1 P25024 3/20 0.32
GPR139 Q6DWJ6 1/20 0.32
FYN P06241 1/20 0.31
PDGFRA P16234 1/20 0.31
AURKB Q96GD4 1/20 0.31
CSNK1G1 Q9HCP0 1/20 0.31
NPC1 O15118 1/20 0.31
ALOX12 P18054 1/20 0.31
RAB9A P51151 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL7804019 0.85 MAPKAPK2 (0.35) MAPKAPK2MAPK14GPR139
Trifluoroacetic Acid SCHEMBL7804017 0.85 CXCR2 (0.37) CXCR2CXCR1NPC1ALOX12RAB9A
Trifluoroacetic Acid SCHEMBL7785571 0.84 MAPKAPK2 (0.35) MAPKAPK2CXCR2MAPK14CXCR1
SCHEMBL7785252 0.83 MAPKAPK2 (0.40) MAPKAPK2CXCR2MAPK14PDGFRAAURKB
Hydrochloric Acid SCHEMBL7785103 0.82 MAPKAPK2 (0.40) MAPKAPK2CXCR2MAPK14PDGFRAAURKB
SCHEMBL7785551 0.82 MAPKAPK2 (0.34) MAPKAPK2MAPK14FYNPDGFRAAURKB
SCHEMBL7780735 0.81 MAPKAPK2 (0.38) MAPKAPK2CXCR2MAPK14
SCHEMBL7789434 0.81 MAPKAPK2 (0.38) MAPKAPK2CXCR2MAPK14
Trifluoroacetic Acid SCHEMBL7780339 0.80 MAPKAPK2 (0.42) MAPKAPK2CXCR2MAPK14CXCR1
Hydrochloric Acid SCHEMBL7803654 0.80 MAPKAPK2 (0.37) MAPKAPK2CXCR2MAPK14

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-6329405-B1 AS ILEAL BILE ACID TRANSPORTER INHIBITOR, FOR THERAPY OF HYPERLIPEMIA SANKYO COMPANY, LIMITED (JP) 2001-12-11 US disclosed