Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.31 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.31 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.31 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.31 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.31 |
| ▸ | GRIN3A | Q8TCU5 | 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 | |
|---|---|---|---|---|
| SCHEMBL11947822 | 0.85 | CYP1A2 (0.36) | CYP1A2CYP2D6ALOX15GRIN2DGRIN3B | |
| SCHEMBL24480647 | 0.84 | CYP1A2 (0.32) | CYP1A2CYP2D6ALOX15 | |
| SCHEMBL21934664 | 0.83 | CYP1A2 (0.36) | CYP1A2CYP2D6ALOX15GRIN2DGRIN3B | |
| SCHEMBL24480845 | 0.79 | — | — | |
| SCHEMBL25935795 | 0.79 | CYP1A2 (0.39) | CYP1A2CYP2D6ALOX15 | |
| SCHEMBL24926104 | 0.78 | — | — | |
| SCHEMBL22564906 | 0.77 | USP2 (0.33) | CYP1A2CYP2D6OPRM1 | |
| SCHEMBL24480556 | 0.76 | ACHE (0.35) | — | |
| SCHEMBL25571573 | 0.76 | TSHR (0.38) | — | |
| SCHEMBL18199683 | 0.76 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023125944-A1 | COMPOUND CONTAINING HETEROCYCLIC RING | 正大天晴药业集团股份有限公司 | 2023-07-06 | — | — | WO | disclosed |