Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | STING1 | Q86WV6 | 1/20 | 0.36 |
| ▸ | NR1H2 | P55055 | 8/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | CTSL | P07711 | 1/20 | 0.34 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.33 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.33 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.32 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.32 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.32 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.32 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL24076617 | 1.00 | STING1 (0.36) | STING1NR1H2PDE4BCA12CA9 | |
| SCHEMBL1551648 | 0.90 | SUV39H2 (0.37) | NR1H2 | |
| SCHEMBL25787027 | 0.83 | NR1H2 (0.35) | NR1H2CA12CA9NR1H3 | |
| SCHEMBL17422746 | 0.82 | NR1H2 (0.34) | NR1H2CA12CA9NR1H3 | |
| SCHEMBL29954465 | 0.82 | AURKA (0.35) | NR1H2CA12CA9NR1H3 | |
| SCHEMBL29955030 | 0.82 | NR1H2 (0.46) | NR1H2CA12CA9KDM4E | |
| SCHEMBL30381658 | 0.82 | STING1 (0.35) | STING1NR1H2PDE4BCTSLMTNR1A | |
| SCHEMBL29953334 | 0.82 | NR1H2 (0.45) | NR1H2CA12CA9MTNR1AMTNR1B | |
| SCHEMBL513258 | 0.82 | NR1H2 (0.45) | NR1H2CA12CA9MTNR1AMTNR1B | |
| SCHEMBL1497620 | 0.82 | NR1H2 (0.46) | NR1H2CA12CA9KDM4E |
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-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 |