Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 1/20 | 0.68 |
| ▸ | CYP2A6 | P11509 | 13/20 | 0.67 |
| ▸ | CYP2B6 | P20813 | 12/20 | 0.67 |
| ▸ | CYP2C19 | P33261 | 12/20 | 0.67 |
| ▸ | CYP2E1 | P05181 | 12/20 | 0.67 |
| ▸ | CYP3A4 | P08684 | 11/20 | 0.67 |
| ▸ | CYP2C9 | P11712 | 10/20 | 0.67 |
| ▸ | CYP2D6 | P10635 | 9/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 10/20 | 0.48 |
| ▸ | CYP2C8 | P10632 | 7/20 | 0.48 |
| ▸ | LOX | P28300 | 5/20 | 0.41 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Iodide SCHEMBL29574376 | 0.97 | LTA4H (0.65) | LTA4HCYP2A6CYP2B6CYP2C19CYP2E1 | |
| SCHEMBL2690127 | 0.82 | LTA4H (1.00) | LTA4HCYP2A6CYP2B6CYP2C19CYP2E1 | |
| SCHEMBL2690207 | 0.81 | CYP2E1 (1.00) | LTA4HCYP2A6CYP2B6CYP2C19CYP2E1 | |
| SCHEMBL30758544 | 0.81 | LTA4H (0.50) | LTA4HCYP2A6CYP2B6CYP2C19CYP2E1 | |
| SCHEMBL9200282 | 0.81 | LTA4H (0.96) | LTA4HCYP2A6CYP2B6CYP2C19CYP2E1 | |
| Iodide SCHEMBL28780492 | 0.81 | LTA4H (0.96) | LTA4HCYP2A6CYP2B6CYP2C19CYP2E1 | |
| Iodide SCHEMBL30758524 | 0.79 | LTA4H (0.49) | LTA4HCYP2A6CYP2B6CYP2C19CYP2E1 | |
| Hydrochloric Acid SCHEMBL31558446 | 0.79 | CYP2A6 (0.96) | LTA4HCYP2A6CYP2B6CYP2C19CYP2E1 | |
| SCHEMBL19531540 | 0.78 | CYP2A6 (0.66) | LTA4HCYP2A6CYP2B6CYP2C19CYP2E1 | |
| SCHEMBL6698000 | 0.78 | CYP2A6 (0.56) | LTA4HCYP2A6CYP2B6CYP2C19CYP2E1 |
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-109713133-B | Organic-inorganic mixed perovskite compound, preparation method and application thereof | 南开大学 | 2022-05-10 | — | — | CN | disclosed |