Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | KMO | O15229 | 1/20 | 0.45 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP4B1 | P13584 | 1/20 | 0.43 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.43 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.43 |
| ▸ | CYP2A7 | P20853 | 1/20 | 0.43 |
| ▸ | CYP3A7 | P24462 | 1/20 | 0.43 |
| ▸ | CYP2F1 | P24903 | 1/20 | 0.43 |
| ▸ | CYP2C18 | P33260 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL88339 | 0.84 | — | — | |
| SCHEMBL28335624 | 0.81 | — | — | |
| SCHEMBL29017383 | 0.81 | — | — | |
| Water SCHEMBL11201989 | 0.81 | — | — | |
| SCHEMBL11013066 | 0.81 | — | — | |
| SCHEMBL9461749 | 0.80 | LTA4H (0.60) | LTA4HTSHRCYP1A1CYP1A2CYP2E1 | |
| SCHEMBL27432466 | 0.79 | ALDH1A1 (0.50) | LTA4HTSHRCYP1A2CYP3A4CYP2C9 | |
| Resorcinol SCHEMBL15775694 | 0.78 | CYP3A4 (0.57) | LTA4HTSHRCYP3A4CYP2C9MEN1 | |
| SCHEMBL11820136 | 0.78 | LTA4H (0.57) | LTA4HTSHRCYP1A1CYP1A2CYP2E1 | |
| SCHEMBL9217378 | 0.78 | LTA4H (0.57) | LTA4HTSHRESR1MEN1KMT2A |
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-116925094-A | Preparation method and application of abietane lactone diterpenoid enantiomer | 深圳市第二人民医院(深圳市转化医学研究院) | 2023-10-24 | — | — | CN | disclosed |