Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL8835795

CC(C(=O)O)(C(=O)CNC(=O)c1cc2c(s1)CCNC2)c1ccccc1.O=C(O)C(F)(F)F

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 9/20 0.54
ITGA2B P08514 9/20 0.54
PNMT P11086 3/20 0.46
POLB P06746 2/20 0.38
KMT2A Q03164 1/20 0.38
TPSAB1 Q15661 1/20 0.38
TPSD1 Q9BZJ3 1/20 0.38
TPSG1 Q9NRR2 1/20 0.38
ALDH1A1 P00352 4/20 0.36
KDM4E B2RXH2 1/20 0.36
RAB9A P51151 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPC1 O15118 1/20 0.35
TP53 P04637 1/20 0.35
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
HTT P42858 1/20 0.35
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34

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 0.79 ITGB3 (0.54) ITGB3ITGA2BPNMTPOLBKMT2A
Trifluoroacetic Acid SCHEMBL8553925 0.76 ITGB3 (0.91) ITGB3ITGA2BPNMTTPSAB1TPSD1
Trifluoroacetic Acid SCHEMBL8557628 0.75 ITGB3 (0.89) ITGB3ITGA2BPNMTPOLBKMT2A
Trifluoroacetic Acid SCHEMBL8835829 0.75 ITGB3 (0.50) ITGB3ITGA2BPNMTPOLBKMT2A
Trifluoroacetic Acid SCHEMBL8836049 0.75 ITGB3 (0.49) ITGB3ITGA2BPNMTKMT2ATPSAB1
Trifluoroacetic Acid SCHEMBL8835440 0.74 ITGB3 (0.46) ITGB3ITGA2BPNMTPOLBKMT2A
Trifluoroacetic Acid SCHEMBL8457040 0.74 PNMT (0.62) ITGB3ITGA2BPNMTTPSAB1TPSD1
Trifluoroacetic Acid SCHEMBL8555000 0.74 ITGB3 (0.75) ITGB3ITGA2BPNMTPOLBKMT2A
Trifluoroacetic Acid SCHEMBL8556044 0.74 ITGB3 (0.90) ITGB3ITGA2BPNMTKMT2ATPSAB1
Trifluoroacetic Acid SCHEMBL8836102 0.74 ITGB3 (0.51) 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