Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.41 |
| ▸ | IKBKB | O14920 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | DHODH | Q02127 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL3289417 | 0.72 | CYP3A4 (0.42) | HSP90AA1CYP3A4ALOX15ALDH1A1GLA | |
| SCHEMBL142562 | 0.72 | HSP90AA1 (0.41) | HSP90AA1IKBKBGLACTDSP1CYP2C9 | |
| SCHEMBL28140395 | 0.70 | CYP3A4 (0.47) | CYP3A4ALOX15GLACTDSP1CYP2C19 | |
| SCHEMBL28459231 | 0.70 | SMN1; SMN2 (0.46) | CYP3A4ALOX15ALDH1A1GLACTDSP1 | |
| SCHEMBL28320415 | 0.69 | RET (0.41) | CYP3A4ALOX15ALDH1A1ALOX12MEN1 | |
| SCHEMBL5830003 | 0.68 | IDO1 (0.40) | CYP3A4ALOX15ALDH1A1ALOX12IDO1 | |
| SCHEMBL7513764 | 0.68 | CYP3A4 (0.42) | HSP90AA1CYP3A4ALOX15ALDH1A1GLA | |
| SCHEMBL30912243 | 0.67 | ALDH1A1 (0.39) | CYP3A4ALOX15ALDH1A1CYP2C19HIF1A | |
| SCHEMBL31443278 | 0.65 | HSP90AA1 (0.40) | HSP90AA1CYP3A4ALOX15ALDH1A1GLA | |
| SCHEMBL4259499 | 0.64 | MAPT (0.41) | HSP90AA1IKBKBCYP3A4ALOX15ALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118047788-A | Isopentenyl phenolic compound, and preparation method and application thereof | 中国医药工业研究总院有限公司 | 2024-05-17 | — | — | CN | disclosed |