Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ASPH | Q12797 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | KDM8 | Q8N371 | 1/20 | 0.38 |
| ▸ | GABRP | O00591 | 1/20 | 0.37 |
| ▸ | GABRD | O14764 | 1/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.37 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.37 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.37 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.37 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.37 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.37 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29106072 | 0.85 | ASPH (0.46) | ASPHALDH1A1CA12CA1CA2 | |
| SCHEMBL29812246 | 0.84 | KMT2A (0.39) | ASPHALDH1A1CA2TSHRKDM4E | |
| SCHEMBL14921073 | 0.81 | ASPH (0.46) | ASPHTSHRKDM4EKDM8HPGD | |
| SCHEMBL29754010 | 0.81 | ASPH (0.46) | ASPHTSHRKDM4EKDM8HPGD | |
| SCHEMBL28450854 | 0.81 | ASPH (0.46) | ASPHKDM4EKDM8GABRPGABRD | |
| SCHEMBL13469245 | 0.80 | KDM4E (0.50) | ASPHALDH1A1CA2KDM4EKDM8 | |
| SCHEMBL30536915 | 0.80 | ASPH (0.45) | ASPHCA12CA1CA2TSHR | |
| SCHEMBL19481003 | 0.80 | ASPH (0.45) | ASPHCA12CA1CA2TSHR | |
| SCHEMBL6215528 | 0.80 | GABRP (0.56) | ASPHKDM4EGABRPGABRDGABRA1 | |
| SCHEMBL19730356 | 0.80 | ASPH (0.45) | ASPHALDH1A1KDM4EKDM8GABRP |
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-116782996-A | Tautomeric ligands enable biomimetic C-H hydroxylation under molecular oxygen | 斯克里普斯研究学院 | 2023-09-19 | — | — | CN | disclosed |