Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL9230724

CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].Cl[Sn+3].Cl[Sn+3].O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F

nearest known ligand 0.47

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Known targets — ChEMBL curated mechanism

ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

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 2)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.47
CA4 P22748 3/20 0.42

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 SCHEMBL9276548 0.88 CA1 (0.47) CA1CA4
Trifluoroacetic Acid SCHEMBL8464128 0.88 CA1 (0.53) CA1CA4
Trifluoroacetic Acid SCHEMBL7949096 0.88 CA1 (0.53) CA1CA4
Trifluoroacetic Acid SCHEMBL14354066 0.88 CA1 (0.53) CA1CA4
Trifluoroacetic Acid SCHEMBL20917785 0.88 CA1 (0.53) CA1CA4
Trifluoroacetic Acid SCHEMBL3204069 0.85 CA1 (0.50) CA1CA4
Trifluoroacetic Acid SCHEMBL2828447 0.84 CA4 (0.38) CA1CA4
Trifluoroacetic Acid SCHEMBL20571141 0.84 CA4 (0.38) CA1CA4
Trifluoroacetic Acid SCHEMBL10703180 0.82 CA1 (0.47) CA1CA4
Acetic Acid SCHEMBL10578729 0.80 CA1 (0.73) CA1CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1105366-A Alkyzin compound and preparation and application of same GOLDSCHMIDT AG TH (DE) 1995-07-19 CN disclosed
US-5426202-A Alkyl tin compounds, their synthesis and electrically conductive and IR-reflecting layers TH. GOLDSCHMIDT AG (DE) 1995-06-20 US disclosed
EP-0636629-A2 Alkyltin compounds, their preparation and agents for the formation of conductif and IR-reflecting layers on glass-, glass-ceramic- or enamel coated surfaces Th. Goldschmidt AG (DE) 1995-02-01 EP disclosed