Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL28290467

COCC(=O)N1CCNCC1.O=C(O)C(F)(F)F

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.49
TPSAB1 Q15661 1/20 0.43
TPSD1 Q9BZJ3 1/20 0.43
TPSG1 Q9NRR2 1/20 0.43
ALDH1A1 P00352 5/20 0.43
CYP1A2 P05177 4/20 0.43
USP2 O75604 7/20 0.42
CYP2C19 P33261 4/20 0.41
CYP2C9 P11712 3/20 0.41
POLB P06746 1/20 0.41
CYP2D6 P10635 7/20 0.41
CYP3A4 P08684 7/20 0.40
MAPK1 P28482 3/20 0.39
TP53 P04637 1/20 0.39
HIF1A Q16665 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TSHR P16473 2/20 0.39
HSD17B10 Q99714 2/20 0.39
HPGD P15428 1/20 0.39

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
SCHEMBL275988 0.88 TPSAB1 (0.51) TPSAB1TPSD1TPSG1ALDH1A1CYP1A2
Hydrochloric Acid SCHEMBL18167985 0.86 TPSAB1 (0.50) TPSAB1TPSD1TPSG1ALDH1A1CYP1A2
Trifluoroacetic Acid SCHEMBL28934495 0.84 PKM (0.47) PKMTPSAB1TPSD1TPSG1ALDH1A1
Trifluoroacetic Acid SCHEMBL27952949 0.83 TPSAB1 (0.42) PKMTPSAB1TPSD1TPSG1POLB
Hydrochloric Acid SCHEMBL18824267 0.80 TPSAB1 (0.45) TPSAB1TPSD1TPSG1ALDH1A1CYP1A2
Trifluoroacetic Acid SCHEMBL25195860 0.79 PKM (0.44) PKMTPSAB1TPSD1TPSG1HPGD
Trifluoroacetic Acid SCHEMBL907665 0.78 PKM (0.43) PKMTPSAB1TPSD1TPSG1ALDH1A1
SCHEMBL10618753 0.78 TPSAB1 (0.41) TPSAB1TPSD1TPSG1ALDH1A1CYP1A2
Trifluoroacetic Acid SCHEMBL22123169 0.77 PKM (0.43) PKMTPSAB1TPSD1TPSG1HRH4
Trifluoroacetic Acid SCHEMBL27188793 0.77 PKM (0.43) PKMTPSAB1TPSD1TPSG1HRH4

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
CN-109563092-B 2-phenylimidazo [4,5-B ] pyridin-7-amine derivatives useful as inhibitors of the activity of the mammalian tyrosine kinase ROR1 坎塞拉有限公司 2021-09-14 CN disclosed
CN-109563092-A It can be used as the 2- phenylimidazole of the active inhibitor of mammal tyrosine kinase ROR1 simultaneously [4,5-B] pyridine -7- amine derivative 坎塞拉有限公司 2019-04-02 CN disclosed