Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6132444

CCOC(=O)c1ccc(-c2cn3nc(-c4ccc(N5CCC(SCCCCCCOC)CC5)cc4)sc3n2)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.40
LMNA P02545 2/20 0.40
TP53 P04637 2/20 0.40
GAA P10253 1/20 0.36
SIRT2 Q8IXJ6 1/20 0.35
DPP4 P27487 1/20 0.34
DPP7 Q9UHL4 1/20 0.34
F10 P00742 1/20 0.34
CA12 O43570 2/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CA9 Q16790 2/20 0.34
THRB P10828 2/20 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 SCHEMBL6132409 0.90 MAPT (0.41) MAPTLMNATP53GAASIRT2
Trifluoroacetic Acid SCHEMBL6134395 0.89 MAPT (0.42) MAPTLMNATP53GAASIRT2
SCHEMBL6132573 0.88 MAPT (0.42) MAPTLMNATP53GAACA12
Trifluoroacetic Acid SCHEMBL6134998 0.87 SIRT2 (0.40) MAPTLMNATP53SIRT2CA12
SCHEMBL6134866 0.83 MAPT (0.44) MAPTLMNATP53GAACA12
Trifluoroacetic Acid SCHEMBL7325659 0.83 SIRT2 (0.46) MAPTLMNATP53GAASIRT2
Trifluoroacetic Acid SCHEMBL7324043 0.82 MTOR (0.42) MAPTLMNATP53SIRT2CA12
Trifluoroacetic Acid SCHEMBL7323148 0.82 LMNA (0.48) MAPTLMNATP53SIRT2CA12
Trifluoroacetic Acid SCHEMBL6132999 0.82 SIRT2 (0.40) MAPTLMNATP53GAASIRT2
Trifluoroacetic Acid SCHEMBL6135113 0.82 MAPT (0.40) MAPTLMNATP53DPP4DPP7

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
US-6884868-B1 Cyclic hexapeptides having antibiotic activity FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-04-26 US disclosed
EP-1173472-A1 CYCLIC HEXAPEPTIDES HAVING ANTIBIOTIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-01-23 EP disclosed
WO-2000064927-A1 CYCLIC HEXAPEPTIDES HAVING ANTIBIOTIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-11-02 WO disclosed