Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 6/20 | 0.51 |
| ▸ | NOS1 | P29475 | 4/20 | 0.51 |
| ▸ | NOS3 | P29474 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CTSS | P25774 | 1/20 | 0.35 |
| ▸ | CTSK | P43235 | 1/20 | 0.35 |
| ▸ | SREBF2 | Q12772 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8326929 | 0.86 | NOS2 (0.48) | NOS2NOS1NOS3KDM4EALDH1A1 | |
| SCHEMBL13040665 | 0.85 | NOS2 (0.42) | NOS2NOS1NOS3 | |
| SCHEMBL2834751 | 0.85 | NOS1 (0.44) | NOS2NOS1NOS3 | |
| SCHEMBL5672155 | 0.85 | NOS2 (0.36) | NOS2NOS1NOS3 | |
| SCHEMBL8329772 | 0.85 | NOS2 (0.39) | NOS2NOS1NOS3 | |
| SCHEMBL2830408 | 0.83 | NOS1 (0.57) | NOS2NOS1NOS3 | |
| SCHEMBL13040656 | 0.82 | NOS2 (0.55) | NOS2NOS1NOS3 | |
| SCHEMBL8329387 | 0.82 | NOS2 (0.55) | NOS2NOS1NOS3 | |
| SCHEMBL8330516 | 0.81 | NOS2 (0.33) | NOS2NOS1NOS3 | |
| SCHEMBL8330518 | 0.81 | NOS2 (0.40) | NOS2NOS1NOS3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8932842-B2 | Aminopyridine dimer compounds, compositions and related methods for neuronal nitric oxide synthase inhibition | NORTHWESTERN UNIVERSITY (US) | 2015-01-13 | — | — | US | disclosed |
| US-5972975-A | Substituted 2-aminopyridines as inhibitors of nitric oxide synthase | MERCK & CO., INC. (US) | 1999-10-26 | — | — | US | disclosed |
| US-5962442-A | ADMINISTERING A 3-OXO-4-AZASTEROID | MERCK & CO., INC. (US) | 1999-10-05 | — | — | US | disclosed |
| WO-1996018616-A1 | SUBSTITUTED 2-AMINOPYRIDINES AS INHIBITORS OF NITRIC OXIDE SYNTHASE | MERCK & CO., INC. (US) | 1996-06-20 | — | — | WO | disclosed |