Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | CNR2 | P34972 | 5/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | TNKS | O95271 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6244730 | 1.00 | CYP3A4 (0.56) | CYP3A4CNR2BCHECNR1TNKS | |
| SCHEMBL6500097 | 0.89 | CNR2 (0.42) | CYP3A4CNR2BCHE | |
| SCHEMBL9978113 | 0.88 | CYP3A4 (0.64) | CYP3A4TNKS | |
| SCHEMBL9978021 | 0.88 | CYP3A4 (0.50) | CYP3A4TNKS | |
| SCHEMBL31069429 | 0.88 | CYP3A4 (0.58) | CYP3A4TNKS | |
| SCHEMBL31069352 | 0.88 | CNR2 (0.41) | CYP3A4CNR2BCHE | |
| SCHEMBL31069331 | 0.87 | CYP3A4 (0.41) | CYP3A4CNR2 | |
| SCHEMBL31069314 | 0.87 | CYP3A4 (0.63) | CYP3A4TNKS | |
| SCHEMBL9977960 | 0.86 | CYP3A4 (0.66) | CYP3A4TNKS | |
| SCHEMBL31069427 | 0.86 | CYP3A4 (0.57) | CYP3A4 |
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 |