Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 20/20 | 0.67 |
| ▸ | PARP2 | Q9UGN5 | 11/20 | 0.67 |
| ▸ | PARP6 | Q2NL67 | 3/20 | 0.62 |
| ▸ | PARP3 | Q9Y6F1 | 3/20 | 0.62 |
| ▸ | TNKS | O95271 | 1/20 | 0.62 |
| ▸ | TIPARP | Q7Z3E1 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL25605455 | 1.00 | PARP1 (0.67) | PARP1PARP2PARP6PARP3TNKS | |
| SCHEMBL25605328 | 0.97 | PARP1 (0.67) | PARP1PARP2PARP6PARP3TNKS | |
| SCHEMBL29397527 | 0.90 | PARP1 (0.65) | PARP1PARP2PARP6PARP3TNKS | |
| SCHEMBL27169477 | 0.90 | PARP1 (0.65) | PARP1PARP2PARP6PARP3TNKS | |
| Hydrochloric Acid SCHEMBL31312822 | 0.89 | PARP1 (0.64) | PARP1PARP2PARP6PARP3TNKS | |
| Hydrochloric Acid SCHEMBL30053682 | 0.89 | PARP1 (0.64) | PARP1PARP2PARP6PARP3TNKS | |
| Hydrochloric Acid SCHEMBL27169435 | 0.89 | PARP1 (0.64) | PARP1PARP2PARP6PARP3TNKS | |
| SCHEMBL31570988 | 0.86 | PARP1 (0.64) | PARP1PARP2PARP6PARP3TNKS | |
| SCHEMBL31571000 | 0.86 | PARP1 (0.65) | PARP1PARP2PARP6PARP3TNKS | |
| SCHEMBL27169472 | 0.86 | PARP1 (0.64) | PARP1PARP2PARP6PARP3TNKS |
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-118119629-A | Nitrogen-containing heterocyclic compound and medical application thereof | 中国医药研究开发中心有限公司 | 2024-05-31 | — | — | CN | disclosed |
| WO-2024067691-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND PHARMACEUTICAL USE THEREOF | 中国医药研究开发中心有限公司 | 2024-04-04 | — | — | WO | disclosed |