Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.43 |
| ▸ | TUBB | P07437 | 1/20 | 0.43 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.43 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.43 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.43 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.43 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.43 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.43 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.43 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.43 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.43 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6932118 | 0.81 | ALDH1A1 (0.59) | CYP2D6CYP1A2CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL6930690 | 0.79 | ALDH1A1 (0.50) | CYP2D6CYP1A2CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL14028547 | 0.77 | ALDH1A1 (0.42) | CYP2D6CYP3A4MEN1GAAKMT2A | |
| SCHEMBL453729 | 0.77 | TRPA1 (0.50) | CYP2D6CYP1A2CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL95127 | 0.75 | TRPA1 (0.48) | CYP2D6CYP1A2CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL6933453 | 0.75 | TRPA1 (0.48) | CYP2D6CYP1A2CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL7165846 | 0.74 | GAA (0.48) | CYP2D6CYP1A2CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL6928569 | 0.73 | CYP1A2 (0.57) | CYP2D6CYP1A2CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL7688086 | 0.73 | CYP1A2 (0.57) | CYP2D6CYP1A2CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL4951647 | 0.70 | ALDH1A1 (0.47) | CYP2D6CYP3A4MEN1KMT2AALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1363587-A1 | NOVEL COUPLER FOR USE IN OXIDATIVE HAIR DYEING | P&G-Clairol, Inc. (US) | 2003-11-26 | — | — | EP | disclosed |
| US-6409773-B1 | AMINOPHENOL COUPLERS | CLAIROL INCORPORATED | 2002-06-25 | — | — | US | disclosed |
| WO-2002047635-A1 | NOVEL COUPLER FOR USE IN OXIDATIVE HAIR DYEING | P&G-CLAIROL, INC. (US) | 2002-06-20 | — | — | WO | disclosed |