Valine

Valine

SCHEMBL9775732

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

nearest known ligand 0.60

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 2/20 0.60
SLC1A3 P43003 2/20 0.38
SLC1A2 P43004 2/20 0.38
SLC1A1 P43005 2/20 0.38
ADH1B P00325 1/20 0.36
ADH1C P00326 1/20 0.36
ADH1A P07327 1/20 0.36
DPP4 P27487 1/20 0.33
FAP Q12884 1/20 0.33
DPP8 Q6V1X1 1/20 0.33
DPP9 Q86TI2 1/20 0.33
DPP7 Q9UHL4 1/20 0.33
GABRP O00591 2/20 0.30
GABRD O14764 2/20 0.30
GABRA1 P14867 2/20 0.30
GABRB1 P18505 2/20 0.30
GABRG2 P18507 2/20 0.30
GABRB3 P28472 2/20 0.30
GABRA5 P31644 2/20 0.30
GABRA3 P34903 2/20 0.30

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
Alanine SCHEMBL23044934 0.85 ADH1B (0.40) SLC7A5SLC1A3SLC1A2SLC1A1ADH1B
SCHEMBL697886 0.85
SCHEMBL9530406 0.85
SCHEMBL697887 0.85
Hydrochloric Acid SCHEMBL28009514 0.83
SCHEMBL28147592 0.83 ADH1B (0.46) SLC7A5ADH1BADH1CADH1AALDH1A1
SCHEMBL4229332 0.83
SCHEMBL4229324 0.83
Valine SCHEMBL7458114 0.81 SLC7A5 (0.68) SLC7A5SLC1A3SLC1A2SLC1A1DPP4
Benzene SCHEMBL28325661 0.81 ADH1B (0.43) ADH1BADH1CADH1AALDH1A1

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-5077426-A PREPARATION OF ALPHA-FORMYLAMINO NITRILES BASF AKTIENGESELLSCHAFT (DE) 1991-12-31 US disclosed