Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TTR | P02766 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.32 |
| ▸ | CBR1 | P16152 | 1/20 | 0.32 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL70607 | 0.78 | CYP3A4 (0.50) | CYP3A4MAPK1TSHRHSP90AA1HPGD | |
| SCHEMBL11151784 | 0.76 | MAPK1 (0.48) | CYP3A4MAPK1TSHRHSP90AA1HPGD | |
| SCHEMBL7743436 | 0.76 | CYP3A4 (0.75) | CYP3A4MAPK1TSHRHSP90AA1HPGD | |
| SCHEMBL68064 | 0.76 | CYP3A4 (0.75) | CYP3A4MAPK1TSHRHSP90AA1HPGD | |
| SCHEMBL31392414 | 0.76 | CYP3A4 (0.75) | CYP3A4MAPK1TSHRHSP90AA1HPGD | |
| SCHEMBL5180281 | 0.70 | TTR (0.49) | CYP3A4MAPK1TSHRTTRHSD17B10 | |
| SCHEMBL9623381 | 0.70 | MEN1 (0.50) | CYP3A4MAPK1 | |
| SCHEMBL13950347 | 0.70 | TTR (0.59) | CYP3A4MAPK1TSHRHSP90AA1HPGD | |
| SCHEMBL21839969 | 0.67 | CYP3A4 (0.55) | CYP3A4MAPK1TSHRHSP90AA1HPGD | |
| SCHEMBL11119604 | 0.67 | CYP3A4 (0.89) | CYP3A4MAPK1TSHRHSP90AA1HPGD |
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-116606321-A | Compound with chloroiodohydroxyquinoline tetravalent platinum structure, preparation method and application thereof | 聊城大学 | 2023-08-18 | — | — | CN | disclosed |