Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 19/20 | 0.48 |
| ▸ | NOS3 | P29474 | 18/20 | 0.48 |
| ▸ | NOS2 | P35228 | 4/20 | 0.47 |
| ▸ | ITK | Q08881 | 1/20 | 0.41 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL15499701 | 0.90 | NOS1 (0.47) | NOS1NOS3NOS2 | |
| SCHEMBL1122396 | 0.86 | NOS3 (0.62) | NOS1NOS3NOS2 | |
| SCHEMBL12253664 | 0.86 | NOS1 (0.63) | NOS1NOS3NOS2 | |
| SCHEMBL12253663 | 0.85 | NOS3 (0.62) | NOS1NOS3NOS2 | |
| Hydrochloric Acid SCHEMBL1122320 | 0.85 | NOS3 (0.63) | NOS1NOS3NOS2 | |
| SCHEMBL1122409 | 0.85 | NOS3 (0.65) | NOS1NOS3NOS2 | |
| SCHEMBL12253662 | 0.84 | NOS3 (0.62) | NOS1NOS3NOS2 | |
| Hydrochloric Acid SCHEMBL1122252 | 0.84 | NOS3 (0.62) | NOS1NOS3NOS2 | |
| SCHEMBL12253661 | 0.83 | NOS3 (0.63) | NOS1NOS3NOS2 | |
| Hydrochloric Acid SCHEMBL1121949 | 0.83 | NOS3 (0.63) | NOS1NOS3NOS2 |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1883451-B9 | SUBSTITUTED INDOLE COMPOUNDS HAVING NOS INHIBITORY ACTIVITY | NEURAXON INC (CA) | 2011-02-09 | — | — | EP | disclosed |
| EP-1883451-B1 | SUBSTITUTED INDOLE COMPOUNDS HAVING NOS INHIBITORY ACTIVITY | NEURAXON INC (CA) | 2010-11-24 | — | — | EP | disclosed |
| WO-2010132072-A1 | TREATMENT OR PREVENTION OF MIGRAINE BY DOSING AT AURA | NEURAXON, INC (CA) | 2010-11-18 | — | — | WO | disclosed |