Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL8836049

O=C(NCCC(Oc1ccccc1)C(=O)O)c1cc2c(s1)CCNC2.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
ITGB3 P05106 8/20 0.49
ITGA2B P08514 8/20 0.49
PNMT P11086 2/20 0.40
TPSAB1 Q15661 1/20 0.39
TPSD1 Q9BZJ3 1/20 0.39
TPSG1 Q9NRR2 1/20 0.39
ALDH1A1 P00352 4/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
PPARG P37231 3/20 0.35
PPARA Q07869 3/20 0.35
PRMT5 O14744 1/20 0.34
WDR77 Q9BQA1 1/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
GLA P06280 1/20 0.34
KMT2A Q03164 1/20 0.34
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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 SCHEMBL8836094 0.85 ITGB3 (0.54) ITGB3ITGA2BPNMTTPSAB1TPSD1
Trifluoroacetic Acid SCHEMBL8555663 0.76 ITGB3 (0.47) ITGB3ITGA2BPNMTTPSAB1TPSD1
Trifluoroacetic Acid SCHEMBL8555202 0.75 ITGB3 (0.67) ITGB3ITGA2BPNMTTPSAB1TPSD1
Trifluoroacetic Acid SCHEMBL8835795 0.75 ITGB3 (0.54) ITGB3ITGA2BPNMTTPSAB1TPSD1
Trifluoroacetic Acid SCHEMBL8836102 0.74 ITGB3 (0.51) ITGB3ITGA2BPNMTTPSAB1TPSD1
Trifluoroacetic Acid SCHEMBL8835829 0.74 ITGB3 (0.50) ITGB3ITGA2BPNMTTPSAB1TPSD1
SCHEMBL8835975 0.73 ITGB3 (0.49) ITGB3ITGA2BPNMTTPSAB1TPSD1
SCHEMBL8835923 0.73 PRMT5 (0.50) PRMT5WDR77
Trifluoroacetic Acid SCHEMBL8835440 0.73 ITGB3 (0.46) ITGB3ITGA2BPNMTTPSAB1TPSD1
Trifluoroacetic Acid SCHEMBL8557628 0.73 ITGB3 (0.89) ITGB3ITGA2BPNMTTPSAB1TPSD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5698692-A INHIBIT BINDING BETWEEN PLATELET MEMBRANE GLYCOPROTEIN AND FIBRINOGEN MEIJI SEIKA KABUSHIKI KAISHA (JP) 1997-12-16 US disclosed