Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL28285384

NC(=O)c1ccn(-c2ccccc2)c1-c1ccccc1.O=C(O)C(F)(F)F

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.42
MAPK1 P28482 2/20 0.40
KDM4E B2RXH2 3/20 0.39
GAA P10253 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
NPC1 O15118 1/20 0.39
MAPT P10636 1/20 0.39
PABPC1 P11940 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
BCAT2 O15382 1/20 0.39
POLB P06746 1/20 0.39
ALDH1A1 P00352 3/20 0.38
CDC7 O00311 2/20 0.38
PARP1 P09874 2/20 0.37
RIPK2 O43353 1/20 0.36
SCN9A Q15858 1/20 0.36
HPGD P15428 2/20 0.36
HSD17B10 Q99714 2/20 0.36

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
SCHEMBL10719764 0.91 NOTUM (0.49) NOTUMMAPK1KDM4EGAAMEN1
SCHEMBL28016911 0.81 MAPK1 (0.47) NOTUMMAPK1KDM4EGAAMEN1
SCHEMBL3491824 0.78 NOTUM (0.61) NOTUMKDM4ETDP1L3MBTL1POLB
SCHEMBL4783773 0.77 NOTUM (0.47) NOTUMMAPK1KDM4EMAPTTDP1
SCHEMBL3492555 0.72 NR4A2 (0.56) NOTUMMAPK1KDM4EGAAMEN1
SCHEMBL28037281 0.72 NOTUM (0.51) NOTUMMAPK1KDM4EMEN1KMT2A
Trifluoroacetic Acid SCHEMBL31255509 0.70 BCAT2 (0.79) KDM4EMEN1KMT2ANPC1MAPT
Trifluoroacetic Acid SCHEMBL18049957 0.70 BCAT2 (0.52) KDM4EMAPTL3MBTL1BCAT2ALDH1A1
Trifluoroacetic Acid SCHEMBL1786045 0.70 BCAT2 (0.79) KDM4EMEN1KMT2ANPC1MAPT
SCHEMBL28686718 0.70 MAPK1 (0.47) MAPK1KDM4EGAAMEN1KMT2A

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
CN-105408321-B Indoles and azole derivatives, their preparation method and the pharmaceutical composition containing them 法国施维雅药厂 2019-03-08 CN disclosed