Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.33 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | PARG | Q86W56 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL31069365 | 0.89 | CYP3A4 (0.36) | CYP3A4 | |
| SCHEMBL31069258 | 0.89 | PTGS2 (0.30) | PTGS2 | |
| SCHEMBL31069392 | 0.88 | PARG (0.36) | PTGS2PARG | |
| SCHEMBL31069270 | 0.88 | HDAC1 (0.32) | CYP3A4 | |
| SCHEMBL31069350 | 0.87 | — | — | |
| SCHEMBL31069420 | 0.87 | SLC6A2 (0.33) | PRMT5WDR77 | |
| SCHEMBL31069321 | 0.87 | CYP3A4 (0.31) | CYP3A4 | |
| SCHEMBL31069351 | 0.86 | CYP3A4 (0.32) | CYP3A4 | |
| SCHEMBL31069327 | 0.85 | — | — | |
| SCHEMBL18056533 | 0.84 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024174953-A1 | BENZIMIDAZOLE DERIVATIVE AND MEDICAL USE THEREOF | 苏州隆博泰药业有限公司 | 2024-08-29 | — | — | WO | claimed |
| WO-2024174953-A1 | BENZIMIDAZOLE DERIVATIVE AND MEDICAL USE THEREOF | 苏州隆博泰药业有限公司 | 2024-08-29 | — | — | WO | disclosed |