Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL9013196

CON=C(C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CCl)CS[C@@H]12)c1nsc(N)n1.O=C(O)C(F)(F)F

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1I2 O75469 6/20 0.57
▸ HTR2C P28335 1/20 0.57
▸ MAPT P10636 3/20 0.55
▸ PPARG P37231 2/20 0.55
▸ SLC22A6 Q4U2R8 2/20 0.55
▸ SLC22A8 Q8TCC7 2/20 0.55
▸ SLC22A11 Q9NSA0 2/20 0.55
▸ ALB P02768 1/20 0.55
▸ TDP1 Q9NUW8 5/20 0.51
▸ PGR P06401 3/20 0.51
▸ HSD17B10 Q99714 3/20 0.51
▸ ALDH1A1 P00352 2/20 0.51
▸ TSHR P16473 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ DAO P14920 1/20 0.49
▸ SNCA P37840 1/20 0.49
▸ CYP2J2 P51589 1/20 0.49
▸ ABCC4 O15439 2/20 0.48
▸ APEX1 P27695 2/20 0.47
▸ CYP1A2 P05177 1/20 0.47

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 SCHEMBL9013145 1.00 NR1I2 (0.57) NR1I2HTR2CMAPTPPARGSLC22A6
Trifluoroacetic Acid SCHEMBL9013142 1.00 NR1I2 (0.57) NR1I2HTR2CMAPTPPARGSLC22A6
Trifluoroacetic Acid SCHEMBL9013193 1.00 NR1I2 (0.57) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL7967102 0.95 NR1I2 (0.62) NR1I2HTR2CMAPTPPARGSLC22A6
Trifluoroacetic Acid SCHEMBL9012917 0.92 NR1I2 (0.52) NR1I2HTR2CMAPTPPARGSLC22A6
Trifluoroacetic Acid SCHEMBL9012912 0.92 NR1I2 (0.52) NR1I2HTR2CMAPTPPARGSLC22A6
Trifluoroacetic Acid SCHEMBL10617983 0.91 MAPT (0.69) NR1I2HTR2CMAPTPPARGSLC22A6
Trifluoroacetic Acid SCHEMBL9012920 0.90 TDP1 (0.48) NR1I2HTR2CMAPTPPARGSLC22A6
Trifluoroacetic Acid SCHEMBL9012923 0.90 TDP1 (0.48) NR1I2HTR2CMAPTPPARGSLC22A6
SCHEMBL24263657 0.89 NR1I2 (0.54) NR1I2HTR2CMAPTPPARGSLC22A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5532354-A ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-07-02 — — US disclosed
US-5401734-A MICROBIOCIDES FUJISAWA PHAMACEUTICAL CO., LTD. (JP) 1995-03-28 — — US disclosed
US-5244890-A Treatment of infectious diseases FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-09-14 — — US disclosed
EP-0345671-A2 Cephem compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-12-13 — — EP disclosed
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