Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL11052838

NCCN.NCCN.NCCN.O=C(O)C(F)(F)F.[Co]

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADORA1ADORA2AADORA2BADORA3PDE3APDE3BPDE4APDE4BPDE4CPDE4D

The experimentally established mechanism targets of Trifluoroacetic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 2/20 0.40
HRH3 Q9Y5N1 2/20 0.40
CA12 O43570 2/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA9 Q16790 2/20 0.40
ODC1 P11926 2/20 0.39
GLRA1 P23415 1/20 0.37
SLC6A9 P48067 1/20 0.37
OR51E2 Q9H255 1/20 0.37
LMNA P02545 2/20 0.37
BLM P54132 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MAPT P10636 1/20 0.37
RAB9A P51151 1/20 0.37
PMP22 Q01453 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HDAC6 Q9UBN7 2/20 0.35
GABRR3 A8MPY1 1/20 0.35
GABRP O00591 1/20 0.35

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 SCHEMBL3149138 0.97 HRH4 (0.41) HRH4HRH3CA12CA1CA2
Trifluoroacetic Acid SCHEMBL10619788 0.97 HRH4 (0.41) HRH4HRH3CA12CA1CA2
Trifluoroacetic Acid SCHEMBL8744507 0.88 ODC1 (0.46) HRH4HRH3CA12CA1CA2
Trifluoroacetic Acid SCHEMBL10624638 0.86 ODC1 (0.45) HRH4HRH3CA12CA1CA2
Trifluoroacetic Acid SCHEMBL1833664 0.85 TSHR (0.47) HRH4HRH3CA12CA1CA2
Trifluoroacetic Acid SCHEMBL6490887 0.85 HRH4 (0.50) HRH4HRH3CA12CA1CA2
Trifluoroacetic Acid SCHEMBL10619767 0.85 ODC1 (0.48) HRH4HRH3CA12CA1CA2
Trifluoroacetic Acid SCHEMBL3149196 0.85 ODC1 (0.48) HRH4HRH3CA12CA1CA2
Trifluoroacetic Acid SCHEMBL29019099 0.84 GABRR1 (0.41) HRH4HRH3CA12CA1CA2
Trifluoroacetic Acid SCHEMBL28235039 0.83 ALDH1A1 (0.38) CA2ODC1SMN1; SMN2THRBTSHR

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4433037-A WITH COBALT AMINE OXIDIZING AGENT AND COMPLEXING AGENT EASTMAN KODAK COMPANY (US) 1984-02-21 US disclosed
US-4410623-A COBALT (III) COMPLEX WITH AMINE LIGAND EASTMAN KODAK COMPANY (US) 1983-10-18 US disclosed
US-4347307-A HEAT TREATMENT OF THE COATED AND DRIED FILM PRIOR TO EXPOSURE AND HEAT DEVELOPMENT; NON SILVER PHOTOGRAPHY EASTMAN KODAK COMPANY (US) 1982-08-31 US disclosed
US-4318977-A PHTHALALDEHYDE REDUCING AGENTS AND S-TRIAZINE OXIDIZEWRS EASTMAN KODAK COMPANY (US) 1982-03-09 US disclosed
US-4308341-A PROVIDING ISOINDOZE DYES BY REACTION OF COBALT AMINE LIGANDS AND AROMATIC DIALDEHYDES EASTMAN KODAK COMPANY (US) 1981-12-29 US disclosed
US-4308342-A COBALT COMPOUND HAVING AMMONIA LIGAND; PHOTOTHERMOGRAPHY EASTMAN KODAK COMPANY (US) 1981-12-29 US disclosed