Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSB | P07858 | 6/20 | 0.49 |
| ▸ | CAPN1 | P07384 | 6/20 | 0.47 |
| ▸ | CTSK | P43235 | 2/20 | 0.44 |
| ▸ | CTSL | P07711 | 1/20 | 0.44 |
| ▸ | CTSH | P09668 | 1/20 | 0.44 |
| ▸ | ACE | P12821 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL19365045 | 0.83 | MMP2 (0.54) | CTSBCAPN1ACE | |
| SCHEMBL11863658 | 0.83 | MMP2 (0.54) | CTSBCAPN1ACE | |
| SCHEMBL24765338 | 0.82 | ACE (0.54) | CTSBACE | |
| SCHEMBL24366151 | 0.81 | CAPN1 (0.57) | CTSBCAPN1ACE | |
| SCHEMBL21653923 | 0.81 | CAPN1 (0.57) | CTSBCAPN1ACE | |
| SCHEMBL11860541 | 0.81 | ATM (0.50) | CTSBCAPN1CTSKCTSLCTSH | |
| SCHEMBL29434637 | 0.80 | CTSB (0.56) | CTSBCAPN1 | |
| SCHEMBL13259262 | 0.79 | ACE (0.50) | CTSBCAPN1CTSKCTSLCTSH | |
| SCHEMBL27376928 | 0.79 | OPRD1 (0.53) | CTSBCTSKCTSL | |
| SCHEMBL1741997 | 0.78 | NPC1 (0.60) | CTSBCAPN1CTSKCTSLCTSH |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022262789-A1 | ANTITUMOR COMPOUND AND USE THEREOF | 明慧医药（杭州）有限公司 | 2022-12-22 | — | — | WO | disclosed |