Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7439665

CC(N)C(=O)O.O=C(O)C(F)(F)F

nearest known ligand 0.43

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 2/20 0.43
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
PTGS1 P23219 1/20 0.39
TP53 P04637 1/20 0.38
GRB2 P62993 1/20 0.37
DPP8 Q6V1X1 3/20 0.36
DPP7 Q9UHL4 3/20 0.36
DPP4 P27487 2/20 0.36
SLC1A3 P43003 2/20 0.34
SLC1A2 P43004 2/20 0.34
SLC1A1 P43005 1/20 0.34
LTA4H P09960 1/20 0.34
PTPN1 P18031 1/20 0.34
GABRP O00591 3/20 0.33
GABRD O14764 3/20 0.33
GABRA1 P14867 3/20 0.33
GABRB1 P18505 3/20 0.33
GABRG2 P18507 3/20 0.33
GABRB3 P28472 3/20 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 SCHEMBL29441736 1.00 SLC7A5 (0.43) SLC7A5ALDH1A1MAPTPTGS1TP53
Trifluoroacetic Acid SCHEMBL6104013 1.00 SLC7A5 (0.43) SLC7A5ALDH1A1MAPTPTGS1TP53
Trifluoroacetic Acid SCHEMBL3416090 0.88 SLC7A5 (0.41) SLC7A5ALDH1A1MAPTPTGS1TP53
Trifluoroacetic Acid SCHEMBL29880406 0.86 SLC7A5 (0.36) SLC7A5ALDH1A1MAPTPTGS1GRB2
Trifluoroacetic Acid SCHEMBL5048203 0.86 SLC7A5 (0.36) SLC7A5ALDH1A1MAPTPTGS1GRB2
Trifluoroacetic Acid SCHEMBL4093986 0.86 SLC7A5 (0.36) SLC7A5ALDH1A1MAPTPTGS1GRB2
Trifluoroacetic Acid SCHEMBL4093984 0.86 SLC7A5 (0.36) SLC7A5ALDH1A1MAPTPTGS1GRB2
Trifluoroacetic Acid SCHEMBL1833665 0.86 TP53 (0.40) SLC7A5ALDH1A1MAPTPTGS1TP53
Trifluoroacetic Acid SCHEMBL27623283 0.82 TP53 (0.42) SLC7A5ALDH1A1MAPTPTGS1TP53
Valine SCHEMBL1761382 0.82 SLC7A5 (0.71) SLC7A5ALDH1A1MAPTPTGS1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1631539-A Amino acid salt ion liquid and its preparation UNIV BEIJING (CN) 2005-06-29 CN disclosed
EP-0669912-A1 N-(3-PIPERIDINYLCARBONYL)-BETA-ALANINE DERIVATIVES AS PAF ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-09-06 EP disclosed
WO-1995008536-A1 N-(3-PIPERIDINYLCARBONYL)-BETA-ALANINE DERIVATIVES AS PAF ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-03-30 WO disclosed
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
US-4970297-A CONTAINING ISOXAZOLE RING SYNTEX (U.S.A.) INC. (US) 1990-11-13 US disclosed