Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.38 |
| ▸ | KAT2B | Q92831 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9187968 | 0.85 | TSHR (0.58) | TSHRCYP3A4ALDH1A1LMNAMAPT | |
| SCHEMBL22897819 | 0.81 | TSHR (0.53) | TSHRCYP3A4ALDH1A1LMNAMAPT | |
| SCHEMBL20126810 | 0.80 | ALDH1A1 (0.49) | TSHRALDH1A1NPC1RAB9AHPGD | |
| SCHEMBL18579528 | 0.77 | TSHR (0.56) | TSHRCYP3A4ALDH1A1LMNAMAPT | |
| SCHEMBL22897863 | 0.76 | TSHR (0.47) | TSHRCYP3A4ALDH1A1LMNAMAPT | |
| SCHEMBL22898025 | 0.76 | NPC1 (0.48) | TSHRCYP3A4ALDH1A1LMNAMAPT | |
| SCHEMBL22898038 | 0.76 | TSHR (0.51) | TSHRCYP3A4ALDH1A1LMNAMAPT | |
| SCHEMBL22897895 | 0.75 | TSHR (0.46) | TSHRCYP3A4ALDH1A1LMNAMAPT | |
| SCHEMBL28679203 | 0.75 | TSHR (0.46) | TSHRCYP3A4ALDH1A1LMNAMAPT | |
| SCHEMBL22897901 | 0.75 | TDP1 (0.38) | CYP3A4ALDH1A1SMN1; SMN2TDP1 |
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 |