Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 4/20 | 0.61 |
| ▸ | NOS3 | P29474 | 3/20 | 0.61 |
| ▸ | NOS2 | P35228 | 3/20 | 0.61 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | COMT | P21964 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8330686 | 0.97 | NOS1 (0.57) | NOS1NOS3NOS2L3MBTL1BACE1 | |
| SCHEMBL7737460 | 0.91 | NOS1 (0.49) | NOS1NOS3NOS2BACE1 | |
| SCHEMBL2834751 | 0.83 | NOS1 (0.44) | NOS1NOS3NOS2 | |
| SCHEMBL2836244 | 0.82 | NOS1 (0.59) | NOS1NOS3NOS2 | |
| SCHEMBL13040656 | 0.81 | NOS2 (0.55) | NOS1NOS3NOS2 | |
| SCHEMBL17721483 | 0.80 | NOS1 (0.52) | NOS1NOS3NOS2 | |
| SCHEMBL6166695 | 0.79 | NOS2 (0.45) | NOS1NOS3NOS2 | |
| SCHEMBL8330518 | 0.79 | NOS2 (0.40) | NOS1NOS3NOS2 | |
| SCHEMBL6164525 | 0.79 | NOS2 (0.39) | NOS1NOS3NOS2 | |
| SCHEMBL2830408 | 0.79 | NOS1 (0.57) | 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 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 |