Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 3/20 | 0.33 |
| ▸ | NOS1 | P29475 | 3/20 | 0.33 |
| ▸ | NOS2 | P35228 | 3/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7625495 | 0.80 | NOS3 (0.39) | NOS3NOS1NOS2 | |
| SCHEMBL7940036 | 0.69 | — | — | |
| SCHEMBL18971597 | 0.67 | — | — | |
| SCHEMBL7624140 | 0.67 | NOS3 (0.37) | NOS3NOS1NOS2 | |
| SCHEMBL7618095 | 0.66 | NOS3 (0.34) | NOS3NOS1NOS2 | |
| SCHEMBL7625212 | 0.62 | — | — | |
| SCHEMBL7626616 | 0.59 | — | — | |
| SCHEMBL24092766 | 0.57 | NOS3 (0.31) | NOS3NOS1NOS2 | |
| SCHEMBL10070411 | 0.53 | NOS3 (0.32) | NOS3NOS1NOS2 | |
| SCHEMBL23913880 | 0.53 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5629322-A | TREATMENT OF NEURODEGENERATIVE DISORDERS, DISORDERS OF GASTROINTESTINAL MOTILITY AND INFLAMMATION | MERCK & CO., INC. (US) | 1997-05-13 | — | — | US | disclosed |
| WO-1996014844-A1 | CYCLIC AMIDINE ANALOGS AS INHIBITORS OF NITRIC OXIDE SYNTHASE | MERCK & CO., INC. (US) | 1996-05-23 | — | — | WO | disclosed |