Valine

Valine

SCHEMBL9318955

C1CCCC1.CC(C)[C@H](N)C(=O)O

nearest known ligand 0.83

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 2/20 0.83
SLC1A3 P43003 5/20 0.42
SLC1A2 P43004 5/20 0.42
SLC1A1 P43005 5/20 0.42
TP53 P04637 1/20 0.38
DPP4 P27487 6/20 0.37
DPP7 Q9UHL4 6/20 0.37
FAP Q12884 4/20 0.37
DPP8 Q6V1X1 4/20 0.37
DPP9 Q86TI2 3/20 0.37
PREP P48147 2/20 0.36
PITRM1 Q5JRX3 1/20 0.36
LAP3 P28838 1/20 0.36

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
Valine SCHEMBL28259048 0.97 SLC7A5 (0.79) SLC7A5SLC1A3SLC1A2SLC1A1TP53
Valine SCHEMBL31618928 0.91
Valine SCHEMBL2785563 0.91 SLC7A5 (1.00) SLC7A5SLC1A3SLC1A2SLC1A1TP53
Valine SCHEMBL29622105 0.91
Valine SCHEMBL43678 0.91
Valine SCHEMBL288203 0.91 SLC7A5 (1.00) SLC7A5SLC1A3SLC1A2SLC1A1TP53
Valine SCHEMBL41225 0.91 SLC7A5 (1.00) SLC7A5SLC1A3SLC1A2SLC1A1TP53
Valine SCHEMBL8516 0.91
Valine SCHEMBL1813972 0.91 SLC7A5 (1.00) SLC7A5SLC1A3SLC1A2SLC1A1TP53
Valine SCHEMBL8515 0.91

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-5294553-A Dissolving grease and oil using trichlorotrifluoroethane solvent and hexane and methyl tert-butyl ether THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE ENVIRONMENTAL PROTECTION AGENCY (US) 1994-03-15 US disclosed