Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 4/20 | 0.57 |
| ▸ | NOS2 | P35228 | 4/20 | 0.57 |
| ▸ | NOS3 | P29474 | 3/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | RXRA | P19793 | 1/20 | 0.35 |
| ▸ | RXRB | P28702 | 1/20 | 0.35 |
| ▸ | RXRG | P48443 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8330574 | 0.97 | NOS1 (0.61) | NOS1NOS2NOS3CYP2D6BACE1 | |
| SCHEMBL7737460 | 0.91 | NOS1 (0.49) | NOS1NOS2NOS3BACE1 | |
| SCHEMBL2836244 | 0.82 | NOS1 (0.59) | NOS1NOS2NOS3 | |
| SCHEMBL6164525 | 0.82 | NOS2 (0.39) | NOS1NOS2NOS3 | |
| SCHEMBL13040653 | 0.81 | NOS2 (0.55) | NOS1NOS2NOS3 | |
| SCHEMBL6167004 | 0.81 | NOS2 (0.38) | NOS1NOS2NOS3 | |
| SCHEMBL8330353 | 0.81 | NOS2 (0.38) | NOS1NOS2NOS3 | |
| SCHEMBL13040655 | 0.81 | NOS2 (0.38) | NOS1NOS2NOS3 | |
| SCHEMBL13040656 | 0.81 | NOS2 (0.55) | NOS1NOS2NOS3 | |
| SCHEMBL6164330 | 0.81 | RXRA (0.46) | NOS1NOS2NOS3KDM4EMAPT |
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-5972975-A | Substituted 2-aminopyridines as inhibitors of nitric oxide synthase | MERCK & CO., INC. (US) | 1999-10-26 | — | — | US | disclosed |
| WO-1996018616-A1 | SUBSTITUTED 2-AMINOPYRIDINES AS INHIBITORS OF NITRIC OXIDE SYNTHASE | MERCK & CO., INC. (US) | 1996-06-20 | — | — | WO | disclosed |