Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | DHPS | P49366 | 1/20 | 0.39 |
| ▸ | HRH4 | Q9H3N8 | 3/20 | 0.37 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | NAMPT | P43490 | 1/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11158901 | 0.98 | DHPS (0.42) | CYP1A2ALOX15NFKB1MAOAMAOB | |
| SCHEMBL11158899 | 0.98 | DHPS (0.42) | CYP1A2ALOX15NFKB1MAOAMAOB | |
| SCHEMBL10567402 | 0.87 | HRH4 (0.31) | HRH4 | |
| SCHEMBL11467208 | 0.84 | MIF (0.39) | HRH4CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL11527369 | 0.80 | HRH4 (0.35) | HRH4CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL11527367 | 0.80 | HRH4 (0.35) | HRH4CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL9777091 | 0.77 | HRH4 (0.32) | HRH4 | |
| SCHEMBL9777093 | 0.77 | HRH4 (0.32) | HRH4 | |
| SCHEMBL11215888 | 0.76 | BCHE (0.32) | HRH4 | |
| SCHEMBL10999299 | 0.76 | HRH4 (0.31) | HRH4 |
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-4803206-A | Antihypertensive acylpyrazines | SCHERING CORPORATION (US) | 1989-02-07 | — | — | US | disclosed |