Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 2/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.44 |
| ▸ | YTHDC1 | Q96MU7 | 2/20 | 0.42 |
| ▸ | CDK1 | P06493 | 3/20 | 0.37 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | THPO | P40225 | 1/20 | 0.35 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.35 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.34 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.34 |
| ▸ | DAO | P14920 | 1/20 | 0.33 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.33 |
| ▸ | CCNB1 | P14635 | 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 | |
|---|---|---|---|---|
| SCHEMBL13335019 | 0.79 | ADORA1 (0.47) | ADORA1ADORA2AYTHDC1CDK1PDE4A | |
| SCHEMBL20200121 | 0.71 | AHCY (0.33) | ADORA1ADORA2A | |
| SCHEMBL12352344 | 0.69 | LMNA (0.42) | ADORA1ADORA2AYTHDC1CDK1PDE4A | |
| SCHEMBL23107523 | 0.69 | NOTUM (0.35) | DAOKCNN3 | |
| SCHEMBL441875 | 0.67 | ADORA1 (0.62) | ADORA1ADORA2AYTHDC1CDK1CYP1A2 | |
| SCHEMBL15186166 | 0.65 | AHCY (0.51) | ADORA1ADORA2ACDK1 | |
| SCHEMBL800728 | 0.65 | ADORA1 (0.46) | ADORA1ADORA2AYTHDC1CDK1PDE4A | |
| SCHEMBL24980509 | 0.65 | LMNA (0.39) | ADORA1ADORA2AYTHDC1PDE4APDE4B | |
| SCHEMBL12332534 | 0.64 | ADORA1 (0.48) | ADORA1ADORA2AYTHDC1CDK1PDE4A | |
| SCHEMBL14438644 | 0.64 | ADORA2A (0.48) | ADORA1ADORA2AYTHDC1CDK1PDE4A |
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 |
|---|---|---|---|---|---|---|---|
| EP-4180434-A1 | PB2 INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF | Sichuan Haisco Pharmaceutical Co., Ltd. (CN) | 2023-05-17 | — | — | EP | disclosed |