Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGMT | P16455 | 1/20 | 0.42 |
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | CA7 | P43166 | 2/20 | 0.34 |
| ▸ | CA9 | Q16790 | 2/20 | 0.34 |
| ▸ | CA4 | P22748 | 1/20 | 0.34 |
| ▸ | ABCG2 | Q9UNQ0 | 4/20 | 0.31 |
| ▸ | CA12 | O43570 | 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 | |
|---|---|---|---|---|
| SCHEMBL26349179 | 1.00 | MGMT (0.42) | MGMTMGLLCA1CA2CA7 | |
| SCHEMBL30455579 | 0.82 | MGMT (0.39) | MGMTMGLLCA1CA2CA7 | |
| SCHEMBL30459733 | 0.82 | MGMT (0.39) | MGMTMGLLCA1CA2CA7 | |
| SCHEMBL26349182 | 0.82 | MGMT (0.39) | MGMTMGLLCA1CA2CA7 | |
| SCHEMBL25495612 | 0.80 | MGMT (0.42) | MGMTMGLLABCG2 | |
| SCHEMBL17262434 | 0.78 | MGMT (0.40) | MGMTMGLLABCG2 | |
| SCHEMBL18212282 | 0.78 | MGMT (0.40) | MGMTMGLLABCG2 | |
| SCHEMBL29199650 | 0.77 | HPGD (0.49) | MGMT | |
| SCHEMBL26349189 | 0.77 | MGMT (0.42) | MGMTMGLL | |
| SCHEMBL14645284 | 0.75 | MGMT (0.46) | MGMTMGLLABCG2 |
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-116322777-A | Heteroaryl and heterocyclyl compounds | 西吉隆医疗股份有限公司 | 2023-06-23 | — | — | CN | disclosed |