Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL1505073

C1CCOC1.O.O=C(O)C(F)(F)F

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-3blaT-4blaT-5blaT-6blaUOE-1dacAdacBdacCfolAfolPftsIgyrAgyrBileSmecAmrcAmrcBmrdAparCparEpbp2pbp4pbpApbpFrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUthyAykgMykgO

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 9)

geneUniProtsupporting neighboursconfidence
DPP4 known ✓ P27487 1/20 0.35
MEN1 known ✓ O00255 1/20 0.30
ALDH1A1 P00352 2/20 0.42
DPP8 Q6V1X1 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
KCNJ1 P48048 1/20 0.34
GLA P06280 1/20 0.31
TP53 P04637 1/20 0.30
KMT2A Q03164 1/20 0.30

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 SCHEMBL2989718 0.97 ALDH1A1 (0.44) ALDH1A1DPP4DPP8L3MBTL1KCNJ1
Trifluoroacetic Acid SCHEMBL28293684 0.95 ALDH1A1 (0.42) ALDH1A1DPP4DPP8L3MBTL1KCNJ1
Trifluoroacetic Acid SCHEMBL8721639 0.95 ALDH1A1 (0.42) ALDH1A1DPP4DPP8L3MBTL1KCNJ1
Trifluoroacetic Acid SCHEMBL28222242 0.92 ALDH1A1 (0.40) ALDH1A1DPP4DPP8L3MBTL1KCNJ1
Trifluoroacetic Acid SCHEMBL9547951 0.89 KCNJ1 (0.39) ALDH1A1DPP4DPP8L3MBTL1KCNJ1
Trifluoroacetic Acid SCHEMBL3746765 0.89 DPP4 (0.37) ALDH1A1DPP4DPP8L3MBTL1KCNJ1
Trifluoroacetic Acid SCHEMBL7276384 0.89 DPP4 (0.37) ALDH1A1DPP4DPP8L3MBTL1KCNJ1
Trifluoroacetic Acid SCHEMBL4797963 0.88 KCNJ1 (0.38) ALDH1A1DPP4DPP8L3MBTL1KCNJ1
Trifluoroacetic Acid SCHEMBL2299667 0.87 DPP4 (0.36) ALDH1A1DPP4DPP8L3MBTL1KCNJ1
Trifluoroacetic Acid SCHEMBL2566861 0.87 DPP4 (0.36) ALDH1A1DPP4DPP8L3MBTL1KCNJ1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109096321-B Preparation method of deoxyguanosine organic synthesis intermediate 中国医学科学院放射医学研究所 2021-02-12 CN disclosed
CN-109096321-A A kind of preparation method of deoxyguanosine class organic synthesis intermediate 中国医学科学院放射医学研究所 2018-12-28 CN disclosed
EP-2292610-A1 Macrolides with VEGF transcription suppression activity MERCIAN CORPORATION (JP) 2011-03-09 EP disclosed
US-7696210-B2 Gonadotropin releasing hormone receptor antagonists WYETH (US) 2010-04-13 US disclosed
US-7667052-B2 Bioactive substance EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-02-23 US disclosed
US-20060079572-A1 Novel bioactive substance MICROBIOPHARM JAPAN CO., LTD. (JP) 2006-04-13 US disclosed
US-7026352-B1 Physiologically active substances MERCIAN CORPORATION (JP) 2006-04-11 US disclosed
US-20060019965-A1 Gonadotropin releasing hormone receptor antagonists WYETH (US) 2006-01-26 US disclosed
EP-1380579-A1 NOVEL PHYSIOLOGICALLY ACTIVE SUBSTANCES MERCIAN CORPORATION (JP) 2004-01-14 EP disclosed
EP-1000075-A4 METHOD OF PRODUCING TIAZOFURIN AND OTHER C-NUCLEOSIDES ICN PHARMACEUTICALS (US) 2001-09-05 EP disclosed
EP-1000075-A1 METHOD OF PRODUCING TIAZOFURIN AND OTHER C-NUCLEOSIDES ICN Pharmaceuticals, Inc. (US) 2000-05-17 EP disclosed
WO-1999000399-A9 METHOD OF PRODUCING TIAZOFURIN AND OTHER C-NUCLEOSIDES ICN PHARMACEUTICALS (US) 1999-04-15 WO disclosed
WO-1999000399-A1 METHOD OF PRODUCING TIAZOFURIN AND OTHER C-NUCLEOSIDES ICN PHARMACEUTICALS, INC. (US) 1999-01-07 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060079572-A1 Novel bioactive substance CASP7, MMP7, BMP4 DPP4 729/4885MEN1 97/4885ALDH1A1 3321/4885
US-20060019965-A1 Gonadotropin releasing hormone receptor antagonists GNRHR, GHRHR, LHCGR DPP4 231/4885MEN1 829/4885ALDH1A1 4733/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.