Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7435083

CC(C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)CN)C(=O)O.O=C(O)C(F)(F)F

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ITGB1 P05556 1/20 0.40
ITGA4 P13612 1/20 0.40
CTSD P07339 6/20 0.37
PTPN1 P18031 3/20 0.36
PTPN2 P17706 1/20 0.36
PTPRA P18433 1/20 0.36
PTPN6 P29350 1/20 0.36
PTPN11 Q06124 1/20 0.36
GNPAT O15228 1/20 0.36
CTSC P53634 1/20 0.36
ENPEP Q07075 5/20 0.35
NPSR1 Q6W5P4 1/20 0.35
CA2 P00918 1/20 0.33
CA4 P22748 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
SCHEMBL9637025 0.92 GNPAT (0.40) CTSDGNPATCTSCENPEPNPSR1
Trifluoroacetic Acid SCHEMBL9614810 0.86 ITGB1 (0.45) ITGB1ITGA4PTPN1
Trifluoroacetic Acid SCHEMBL7432808 0.85 GNPAT (0.47) CTSDPTPN1GNPATENPEP
SCHEMBL30880105 0.84 ENPEP (0.45) CTSDGNPATENPEP
Trifluoroacetic Acid SCHEMBL4392857 0.83 NPSR1 (0.38) CTSDCTSCNPSR1
Trifluoroacetic Acid SCHEMBL7313048 0.82 ITGB1 (0.43) ITGB1ITGA4PTPN1
SCHEMBL30434998 0.82 ECE1 (0.47) CTSDCTSCNPSR1
SCHEMBL30792484 0.82 PDCD1LG2 (0.43) GNPATCTSCENPEPCA2CA4
SCHEMBL30695562 0.81 CTSD (0.44) CTSDGNPATCTSCENPEP
SCHEMBL31031496 0.81 CTSC (0.42) CTSCENPEPNPSR1

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
EP-0577775-A4 ANTI-THROMBOTIC PEPTIDES AND PSEUDOPEPTIDES. RHONE POULENC RORER INT (US) 1995-01-11 EP disclosed
EP-0577775-A1 ANTI-THROMBOTIC PEPTIDES AND PSEUDOPEPTIDES RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1994-01-12 EP disclosed
WO-1992017196-A1 ANTI-THROMBOTIC PEPTIDES AND PSEUDOPEPTIDES RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1992-10-15 WO disclosed