Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | ATF4 | P18848 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | CASP3 | P42574 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL22897834 | 0.85 | MAPT (0.47) | CYP1A2CYP2C9CYP2D6CYP2C19MAPT | |
| SCHEMBL22897465 | 0.85 | CYP1A2 (0.47) | CYP1A2CYP2C9MAPTPOLBADORA3 | |
| SCHEMBL22660837 | 0.78 | PTGS1 (0.39) | CYP1A2CYP2C9CYP2D6CYP2C19MAPT | |
| SCHEMBL17454042 | 0.77 | KMT2A (0.40) | MAPTPOLBALDH1A1KMT2A | |
| SCHEMBL16073029 | 0.75 | ALDH1A1 (0.43) | MAPTNOTUMPOLBADORA3ALDH1A1 | |
| SCHEMBL28701030 | 0.74 | ALDH1A1 (0.42) | MAPTALDH1A1PKMMEN1KMT2A | |
| SCHEMBL14577291 | 0.74 | RXRA (0.42) | CYP1A2MAPTPOLBALDH1A1 | |
| SCHEMBL14617274 | 0.72 | RXRA (0.35) | CYP1A2CYP2C9CYP2D6CYP2C19 | |
| SCHEMBL3589633 | 0.72 | NQO1 (0.50) | CYP2C9MAPTTDP1 | |
| SCHEMBL1844349 | 0.72 | NOTUM (0.41) | CYP1A2CYP2C9CYP2C19NOTUMMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114072000-A | Molecules having certain pesticidal effects and intermediates, compositions and methods related thereto | 科迪华农业科技有限责任公司 | 2022-02-18 | — | — | CN | disclosed |
| WO-2021011722-A1 | MOLECULES HAVING CERTAIN PESTICIDAL UTILITIES, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES RELATED THERETO | DOW AGROSCIENCES LLC (US) | 2021-01-21 | — | — | WO | disclosed |