Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 7/20 | 0.58 |
| ▸ | CA1 | P00915 | 7/20 | 0.58 |
| ▸ | CA2 | P00918 | 7/20 | 0.58 |
| ▸ | CA9 | Q16790 | 7/20 | 0.58 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.45 |
| ▸ | BRD4 | O60885 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | SUCNR1 | Q9BXA5 | 5/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.42 |
| ▸ | ITK | Q08881 | 1/20 | 0.42 |
| ▸ | MGLL | Q99685 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL30283382 | 1.00 | CA12 (0.58) | CA12CA1CA2CA9PDK2 | |
| SCHEMBL30314725 | 0.88 | CA12 (0.50) | CA12CA1CA2CA9PDK2 | |
| SCHEMBL29347119 | 0.86 | CA12 (0.55) | CA12CA1CA2CA9PDK2 | |
| SCHEMBL18103557 | 0.85 | CA12 (0.56) | CA12CA1CA2CA9PDK2 | |
| SCHEMBL29337590 | 0.82 | CA12 (0.53) | CA12CA1CA2CA9PDK2 | |
| SCHEMBL23901546 | 0.82 | CA12 (0.61) | CA12CA1CA2CA9PDK2 | |
| SCHEMBL25080803 | 0.81 | CA12 (0.65) | CA12CA1CA2CA9PDK2 | |
| SCHEMBL30283341 | 0.81 | CA12 (0.61) | CA12CA1CA2CA9PDK2 | |
| SCHEMBL29269474 | 0.81 | CA12 (0.61) | CA12CA1CA2CA9PDK2 | |
| SCHEMBL14313674 | 0.81 | CA12 (0.70) | CA12CA1CA2CA9TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-118251383-A | Macrocyclic compounds as proteasome beta subunit type 5 inhibitors | 利德探索中心有限公司 | 2024-06-25 | — | — | CN | disclosed |