Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP30 | Q70CQ3 | 4/20 | 0.49 |
| ▸ | MAPT | P10636 | 5/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | TNK2 | Q07912 | 1/20 | 0.42 |
| ▸ | TNK1 | Q13470 | 1/20 | 0.42 |
| ▸ | BMPR1B | O00238 | 1/20 | 0.41 |
| ▸ | BMPR1A | P36894 | 1/20 | 0.41 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.41 |
| ▸ | ACVRL1 | P37023 | 1/20 | 0.41 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | HPGDS | O60760 | 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 | |
|---|---|---|---|---|
| SCHEMBL29115574 | 1.00 | USP30 (0.49) | USP30MAPTALDH1A1POLBPARP1 | |
| SCHEMBL29115395 | 1.00 | USP30 (0.49) | USP30MAPTALDH1A1POLBPARP1 | |
| SCHEMBL29115394 | 1.00 | USP30 (0.49) | USP30MAPTALDH1A1POLBPARP1 | |
| SCHEMBL531747 | 0.89 | USP30 (0.54) | USP30MAPTALDH1A1POLBPARP1 | |
| Hydrochloric Acid SCHEMBL709154 | 0.88 | USP30 (0.53) | USP30MAPTALDH1A1POLBPARP1 | |
| SCHEMBL29085179 | 0.82 | USP30 (0.56) | USP30MAPTALDH1A1POLBHPGD | |
| SCHEMBL29085200 | 0.82 | USP30 (0.56) | USP30MAPTALDH1A1POLBHPGD | |
| SCHEMBL29960478 | 0.82 | USP30 (0.56) | USP30MAPTALDH1A1POLBHPGD | |
| SCHEMBL29085175 | 0.82 | USP30 (0.56) | USP30MAPTALDH1A1POLBHPGD | |
| SCHEMBL531792 | 0.80 | MAPT (0.50) | MAPTALDH1A1PARP1TNK1GAA |
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-116710433-A | Selective PARP1 inhibitor and application thereof | 成都百裕制药股份有限公司 | 2023-09-05 | — | — | CN | disclosed |
| WO-2022222966-A1 | SELECTIVE PARP1 INHIBITOR AND APPLICATION THEREOF | 成都百裕制药股份有限公司 | 2022-10-27 | — | — | WO | disclosed |