SCHEMBL13409447

SCHEMBL13409447

NC(CCC=O)C(=O)ON=O

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ARG2 P78540 1/20 0.31

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
SCHEMBL15700550 0.78 ARG2 (0.33) ARG2
SCHEMBL15845451 0.78 ARG2 (0.33) ARG2
SCHEMBL27686000 0.76 P2RY10 (0.36) ARG2
SCHEMBL2514287 0.76 ALOX15 (0.54) —
Hydrochloric Acid SCHEMBL22345834 0.76 ARG2 (0.32) ARG2
SCHEMBL29588125 0.76 ANPEP (0.36) —
SCHEMBL13662314 0.76 P2RY10 (0.36) ARG2
SCHEMBL22440732 0.76 SLC1A2 (0.38) —
SCHEMBL7398739 0.74 — —
SCHEMBL19696557 0.74 — —

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-7691907-B2 Methods and composition based on discovery of metabolism of nitroglycerin DUKE UNIVERSITY (US) 2010-04-06 — — US disclosed
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