Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 7/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.42 |
| ▸ | CYP2E1 | P05181 | 2/20 | 0.42 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.42 |
| ▸ | ALK | Q9UM73 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | BTK | Q06187 | 1/20 | 0.40 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | MAP2K4 | P45985 | 1/20 | 0.38 |
| ▸ | TYMP | P19971 | 1/20 | 0.38 |
| ▸ | METAP2 | P50579 | 1/20 | 0.38 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2723781 | 0.90 | ALK (0.39) | CYP2A6CYP3A4CYP2E1CYP2B6ALK | |
| SCHEMBL16670591 | 0.84 | CYP1A2 (0.40) | CYP2A6CYP3A4CYP2E1CYP2B6ALK | |
| SCHEMBL16671156 | 0.73 | PKM (0.42) | CYP1A2GSK3AGSK3BDYRK1A | |
| SCHEMBL30898239 | 0.72 | YTHDC1 (0.50) | CYP2A6CYP3A4CYP2E1CYP2B6ALK | |
| SCHEMBL28021139 | 0.71 | IDO1 (0.54) | CYP2A6CYP3A4CYP2E1CYP2B6ALK | |
| SCHEMBL16671557 | 0.70 | ALK (0.40) | CYP2A6CYP3A4ALKCYP2C9CYP2C19 | |
| SCHEMBL16200084 | 0.67 | CYP2A6 (0.41) | CYP2A6CYP3A4CYP2E1CYP2B6ALK | |
| SCHEMBL22801811 | 0.67 | FYN (0.43) | CYP2A6CYP3A4CYP2E1CYP2B6ALK | |
| SCHEMBL15660759 | 0.66 | IDO1 (0.55) | CYP2A6CYP3A4CYP2E1CYP2B6ALDH1A1 | |
| SCHEMBL16071467 | 0.66 | SMN1; SMN2 (0.58) | CYP2A6CYP3A4CYP2E1CYP2B6ALK |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3071036-A1 | PESTICIDAL COMPOSITIONS AND RELATED METHODS | Dow AgroSciences LLC (US) | 2016-09-28 | — | — | EP | disclosed |
| EP-3060047-A1 | PESTICIDAL COMPOSITIONS AND RELATED METHODS | Dow AgroSciences, LLC (US) | 2016-08-31 | — | — | EP | disclosed |
| WO-2015061157-A1 | PESTICIDAL COMPOSITIONS AND RELATED METHODS | DOW AGROSCIENCES LLC (US) | 2015-04-30 | — | — | WO | disclosed |
| WO-2015061165-A1 | PESTICIDAL COMPOSITIONS AND RELATED METHODS | DOW AGROSCIENCES LLC (US) | 2015-04-30 | — | — | WO | disclosed |