Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 5/20 | 0.68 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.68 |
| ▸ | CYP1B1 | Q16678 | 5/20 | 0.68 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.68 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.68 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.60 |
| ▸ | APP | P05067 | 2/20 | 0.60 |
| ▸ | GAA | P10253 | 1/20 | 0.60 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.60 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.60 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.59 |
| ▸ | MAPT | P10636 | 5/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | GSK3B | P49841 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL10735172 | 1.00 | CYP1A1 (0.68) | CYP1A1CYP1A2CYP1B1CYP3A4CYP2D6 | |
| SCHEMBL1322029 | 0.85 | CYP1A1 (0.82) | CYP1A1CYP1A2CYP1B1CYP3A4CYP2D6 | |
| SCHEMBL1322027 | 0.85 | CYP1A1 (0.82) | CYP1A1CYP1A2CYP1B1CYP3A4CYP2D6 | |
| Niacinamide SCHEMBL27641063 | 0.84 | F7 (0.79) | CYP1A1CYP1A2CYP1B1CYP3A4CYP2D6 | |
| Niacinamide SCHEMBL19876218 | 0.84 | F7 (0.79) | CYP1A1CYP1A2CYP1B1CYP3A4CYP2D6 | |
| Niacinamide SCHEMBL27698255 | 0.84 | F7 (0.79) | CYP1A1CYP1A2CYP1B1CYP3A4CYP2D6 | |
| Niacinamide SCHEMBL29204086 | 0.84 | F7 (0.79) | CYP1A1CYP1A2CYP1B1CYP3A4CYP2D6 | |
| SCHEMBL10036802 | 0.83 | CYP1A1 (0.65) | CYP1A1CYP1A2CYP1B1CYP3A4CYP2D6 | |
| SCHEMBL27497512 | 0.83 | CYP1A1 (0.65) | CYP1A1CYP1A2CYP1B1CYP3A4CYP2D6 | |
| SCHEMBL10001058 | 0.81 | CYP1A1 (0.63) | CYP1A1CYP1A2CYP1B1CYP3A4CYP2D6 |
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-4710508-A | ANALGESICS | WARNER-LAMBERT COMPANY (US) | 1987-12-01 | — | — | US | disclosed |