Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | DHODH | Q02127 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | BCL6 | P41182 | 1/20 | 0.37 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | FLT1 | P17948 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9469965 | 0.85 | DHODH (0.48) | DHODHGAAMEN1KMT2AALDH1A1 | |
| SCHEMBL5252795 | 0.81 | DHODH (0.51) | CYP1A2CYP2C19CYP3A4CYP2C9DHODH | |
| SCHEMBL9753940 | 0.77 | BRD4 (0.48) | DHODHGAAMEN1KMT2AALDH1A1 | |
| SCHEMBL9470286 | 0.76 | DHODH (0.36) | DHODHGAAMEN1KMT2AALDH1A1 | |
| SCHEMBL9470451 | 0.74 | DHODH (0.51) | CYP1A2CYP2D6CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL1908379 | 0.74 | DHODH (0.56) | CYP1A2CYP2D6CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL1375014 | 0.74 | DHODH (0.56) | DHODHGAAMEN1KMT2AALDH1A1 | |
| SCHEMBL27975923 | 0.71 | DHODH (0.47) | CYP1A2CYP2D6CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL3633702 | 0.71 | DHODH (0.51) | DHODHGAAMEN1KMT2AALDH1A1 | |
| SCHEMBL7296244 | 0.71 | HRH1 (0.57) | CYP1A2CYP2D6CYP2C19CYP3A4CYP2C9 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5519037-A | N-cyanoamidine derivatives as anti-influenza agents | AMERICAN HOME PRODUCTS CORPORATION (US) | 1996-05-21 | — | — | US | disclosed |
| US-5475012-A | Antiviral against influenza A | AMERICAN HOME PRODUCTS CORPORATION (US) | 1995-12-12 | — | — | US | disclosed |
| US-5380734-A | N-cyanoamidine derivatives as anti-influenza agents | AMERICAN HOME PRODUCTS CORPORATION (US) | 1995-01-10 | — | — | US | disclosed |