Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 5/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.54 |
| ▸ | THRA | P10827 | 2/20 | 0.44 |
| ▸ | THRB | P10828 | 2/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | LPL | P06858 | 4/20 | 0.38 |
| ▸ | LIPG | Q9Y5X9 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.38 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.38 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.38 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.38 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.38 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.38 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL13524725 | 0.74 | CYP3A4 (0.58) | CYP3A4CYP2D6CYP2C9THRATHRB | |
| SCHEMBL10253118 | 0.74 | CYP3A4 (0.58) | CYP3A4CYP2D6CYP2C9THRATHRB | |
| SCHEMBL14430275 | 0.74 | CYP3A4 (0.68) | CYP3A4CYP2D6CYP2C9THRATHRB | |
| SCHEMBL5920334 | 0.73 | CYP3A4 (0.66) | CYP3A4CYP2D6CYP2C9THRATHRB | |
| SCHEMBL5921414 | 0.73 | CYP3A4 (0.66) | CYP3A4CYP2D6CYP2C9THRATHRB | |
| SCHEMBL5680616 | 0.73 | CYP3A4 (0.66) | CYP3A4CYP2D6CYP2C9THRATHRB | |
| SCHEMBL5678389 | 0.73 | CYP3A4 (0.66) | CYP3A4CYP2D6CYP2C9THRATHRB | |
| SCHEMBL11057328 | 0.69 | CYP3A4 (0.55) | CYP3A4CYP2D6CYP2C9THRATHRB | |
| SCHEMBL6635785 | 0.69 | CYP3A4 (0.60) | CYP3A4CYP2D6CYP2C9THRATHRB | |
| SCHEMBL11524101 | 0.69 | CYP3A4 (0.60) | CYP3A4CYP2D6CYP2C9THRATHRB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20160282694-A1 | ELECTROCHROMIC COMPOSITION | ESSILOR INTERNATIONAL (COMPAGNIE GENERALE D'OPTIQUE) (FR) | 2016-09-29 | — | — | US | disclosed |
| US-20160231636-A1 | ELECTROCHROMIC COMPOSITION | ESSILOR INTERNATIONAL (COMPAGNIE GENERALE D'OPTIQUE) (FR) | 2016-08-11 | — | — | US | disclosed |