Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | GLA | P06280 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | ATM | Q13315 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | GRIN1 | Q05586 | 5/20 | 0.49 |
| ▸ | GRIN2B | Q13224 | 5/20 | 0.49 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.44 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.43 |
| ▸ | ACP1 | P24666 | 1/20 | 0.42 |
| ▸ | CCR3 | P51677 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL25787876 | 1.00 | ALDH1A1 (0.54) | ALDH1A1KDM4EGLAGAAMAPT | |
| SCHEMBL24077244 | 0.90 | ALDH1A1 (0.53) | ALDH1A1KDM4EGLAGAAMAPT | |
| SCHEMBL24077242 | 0.90 | GRIN2B (0.60) | ALDH1A1KDM4EGLAGAAMAPT | |
| SCHEMBL24077248 | 0.89 | GRIN1 (0.47) | ALDH1A1KDM4EGLAGAAMAPT | |
| SCHEMBL24077247 | 0.87 | ALDH1A1 (0.55) | ALDH1A1KDM4EGLAGAAMAPT | |
| SCHEMBL30381307 | 0.87 | ALDH1A1 (0.55) | ALDH1A1KDM4EGLAGAAMAPT | |
| SCHEMBL24076629 | 0.82 | GRIN1 (0.53) | ALDH1A1KDM4EGLAGAAMAPT | |
| SCHEMBL24077240 | 0.82 | GRIN1 (0.48) | KDM4EMAPTGRIN1GRIN2BCHEK1 | |
| SCHEMBL24076658 | 0.82 | GRIN2B (0.53) | ALDH1A1KDM4EGLAGAAMAPT | |
| SCHEMBL30381655 | 0.82 | GRIN2B (0.53) | ALDH1A1KDM4EGLAGAAMAPT |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116057053-B | 5-Membered heteroaryl derivatives containing at least one N and pharmaceutical compositions containing the same as active ingredient for preventing or treating mental disorders | 特立尼奥公司 | 2024-12-31 | — | — | CN | claimed |
| CN-116057053-A | 5-membered heteroaryl derivatives containing at least one N and pharmaceutical compositions containing the same as active ingredient for preventing or treating mental disorders | 大邱庆北尖端医疗产业振兴财团 | 2023-05-02 | — | — | CN | claimed |
| CN-116057053-B | 5-Membered heteroaryl derivatives containing at least one N and pharmaceutical compositions containing the same as active ingredient for preventing or treating mental disorders | 特立尼奥公司 | 2024-12-31 | — | — | CN | disclosed |
| CN-116057053-A | 5-membered heteroaryl derivatives containing at least one N and pharmaceutical compositions containing the same as active ingredient for preventing or treating mental disorders | 大邱庆北尖端医疗产业振兴财团 | 2023-05-02 | — | — | CN | disclosed |
| EP-4159726-A1 | 5-MEMBERED HETEROARYL DERIVATIVE CONTAINING AT LEAST ONE N, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING MENTAL DISORDERS, CONTAINING SAME AS ACTIVE INGREDIENT | Daegu-Gyeongbuk Medical Innovation Foundation (KR) | 2023-04-05 | — | — | EP | disclosed |