Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 7/20 | 0.52 |
| ▸ | NOS2 | P35228 | 6/20 | 0.52 |
| ▸ | NOS3 | P29474 | 6/20 | 0.51 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.50 |
| ▸ | NCF1 | P14598 | 1/20 | 0.48 |
| ▸ | DNM2 | P50570 | 8/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL17985477 | 0.90 | NOS1 (0.56) | NOS1NOS2NOS3DNM2 | |
| SCHEMBL11187910 | 0.83 | DNM2 (0.55) | NOS1NOS2NOS3HRH3NCF1 | |
| SCHEMBL11446516 | 0.80 | DNM2 (0.46) | HRH3NCF1DNM2CYP2C19 | |
| SCHEMBL26704681 | 0.75 | NOS2 (0.47) | NOS1NOS2NOS3HRH3DNM2 | |
| SCHEMBL3222006 | 0.75 | HRH3 (0.59) | NOS1NOS2NOS3HRH3NCF1 | |
| SCHEMBL11464694 | 0.72 | DNM2 (0.58) | HRH3NCF1DNM2CYP2C19 | |
| SCHEMBL11454656 | 0.72 | DNM2 (0.55) | NOS1NOS2NOS3DNM2 | |
| SCHEMBL3209288 | 0.72 | CYP2D6 (0.64) | HRH3DNM2CYP2C19 | |
| SCHEMBL12698 | 0.71 | CYP2C19 (0.60) | NOS2HRH3DNM2CYP2C19 | |
| SCHEMBL2168204 | 0.70 | HRH3 (0.54) | HRH3NCF1DNM2CYP2C19 |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4203988-A | ANTISECRETORY AGENTS | MERCK & CO., INC. (US) | 1980-05-20 | — | — | US | disclosed |