Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.31 |
| ▸ | ESPL1 | Q14674 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22714393 | 1.00 | CA1 (0.32) | CA1CA2NPC1RAB9AALDH1A1 | |
| SCHEMBL30899567 | 0.84 | CA1 (0.35) | CA1CA2NPC1RAB9AALDH1A1 | |
| SCHEMBL22714335 | 0.84 | CA1 (0.35) | CA1CA2NPC1RAB9AALDH1A1 | |
| SCHEMBL22714416 | 0.83 | CA1 (0.34) | CA1CA2 | |
| SCHEMBL30899561 | 0.83 | CA1 (0.34) | CA1CA2 | |
| SCHEMBL22714353 | 0.79 | CA1 (0.41) | CA1CA2NPC1RAB9AALDH1A1 | |
| SCHEMBL29438166 | 0.79 | CA1 (0.41) | CA1CA2NPC1RAB9AALDH1A1 | |
| SCHEMBL30899575 | 0.79 | CA1 (0.31) | CA1CA2 | |
| SCHEMBL22714352 | 0.79 | CA1 (0.31) | CA1CA2 | |
| SCHEMBL21635547 | 0.78 | MAPT (0.38) | CA1CA2NPC1RAB9AALDH1A1 |
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-113874368-B | Herbicidal compounds | 先正达农作物保护股份公司 | 2024-03-08 | — | — | CN | disclosed |