Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | RXRA | P19793 | 6/20 | 0.38 |
| ▸ | RXRB | P28702 | 2/20 | 0.38 |
| ▸ | RXRG | P48443 | 2/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | MLYCD | O95822 | 1/20 | 0.34 |
| ▸ | MET | P08581 | 1/20 | 0.34 |
| ▸ | POLQ | O75417 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22897709 | 0.81 | AAK1 (0.38) | RXRARXRBRXRGHSP90AA1HSP90AB1 | |
| SCHEMBL9135996 | 0.80 | TDP1 (0.44) | SMN1; SMN2CYP3A4LMNAALDH1A1GLA | |
| SCHEMBL22897762 | 0.80 | ALDH1A1 (0.41) | SMN1; SMN2HSP90AA1HSP90AB1LMNAALDH1A1 | |
| SCHEMBL14116544 | 0.78 | SMN1; SMN2 (0.41) | SMN1; SMN2RXRARXRBRXRGCYP2C9 | |
| SCHEMBL22897580 | 0.77 | S100B (0.55) | SMN1; SMN2RXRARXRBRXRGCYP3A4 | |
| SCHEMBL29559798 | 0.77 | S100B (0.55) | SMN1; SMN2RXRARXRBRXRGCYP3A4 | |
| SCHEMBL29561034 | 0.74 | SMN1; SMN2 (0.45) | SMN1; SMN2RXRARXRBRXRGLMNA | |
| SCHEMBL22897689 | 0.74 | SMN1; SMN2 (0.45) | SMN1; SMN2RXRARXRBRXRGLMNA | |
| SCHEMBL22537737 | 0.74 | OXTR (0.45) | SMN1; SMN2HSP90AA1HSP90AB1CYP3A4LMNA | |
| SCHEMBL22897746 | 0.73 | AAK1 (0.37) | SMN1; SMN2RXRARXRBRXRGHSP90AA1 |
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 |