Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 3/20 | 0.52 |
| ▸ | ERCC1 | P07992 | 4/20 | 0.50 |
| ▸ | ERCC4 | Q92889 | 4/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.50 |
| ▸ | GALR3 | O60755 | 1/20 | 0.49 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | GGPS1 | O95749 | 1/20 | 0.49 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL657437 | 1.00 | IDO1 (0.52) | IDO1ERCC1ERCC4CYP1A2CYP3A4 | |
| SCHEMBL260323 | 0.86 | L3MBTL1 (0.55) | IDO1ERCC1ERCC4P2RX7TDP1 | |
| SCHEMBL29718886 | 0.86 | L3MBTL1 (0.55) | IDO1ERCC1ERCC4P2RX7TDP1 | |
| SCHEMBL28940593 | 0.85 | IDO1 (0.54) | IDO1ERCC1ERCC4CYP1A2CYP3A4 | |
| SCHEMBL29419329 | 0.83 | CHRM1 (0.57) | IDO1ERCC1ERCC4CYP1A2CYP3A4 | |
| SCHEMBL260512 | 0.83 | CHRM1 (0.57) | IDO1ERCC1ERCC4CYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL2532568 | 0.82 | CHRM1 (0.55) | IDO1ERCC1ERCC4CYP2C9P2RX7 | |
| SCHEMBL20796876 | 0.82 | GALR3 (0.55) | IDO1ERCC1ERCC4CYP1A2CYP3A4 | |
| SCHEMBL29712851 | 0.82 | IDO1 (0.50) | IDO1ERCC1ERCC4CYP1A2CYP3A4 | |
| SCHEMBL4686080 | 0.82 | IDO1 (0.50) | IDO1ERCC1ERCC4CYP1A2CYP3A4 |
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-113880764-B | Sinomenine derivative and preparation method and application thereof | 北京师范大学 | 2023-04-18 | — | — | CN | disclosed |