Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNQ2 | O43526 | 1/20 | 0.38 |
| ▸ | JAK2 | O60674 | 1/20 | 0.38 |
| ▸ | JAK1 | P23458 | 1/20 | 0.38 |
| ▸ | TYK2 | P29597 | 1/20 | 0.38 |
| ▸ | JAK3 | P52333 | 1/20 | 0.38 |
| ▸ | ADAMTS4 | O75173 | 2/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.37 |
| ▸ | GRIN2D | O15399 | 3/20 | 0.35 |
| ▸ | GRIN3B | O60391 | 3/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 3/20 | 0.35 |
| ▸ | GRIN2A | Q12879 | 3/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.35 |
| ▸ | GRIN2C | Q14957 | 3/20 | 0.35 |
| ▸ | GRIN3A | Q8TCU5 | 3/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.35 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.35 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL30487432 | 1.00 | KCNQ2 (0.38) | KCNQ2JAK2JAK1TYK2JAK3 | |
| SCHEMBL25244708 | 0.83 | GRIN2D (0.42) | KCNQ2JAK2JAK1TYK2JAK3 | |
| SCHEMBL31020092 | 0.83 | GRIN2D (0.42) | KCNQ2JAK2JAK1TYK2JAK3 | |
| SCHEMBL30487352 | 0.83 | RAB9A (0.42) | KCNQ2JAK2JAK1TYK2JAK3 | |
| SCHEMBL25247526 | 0.83 | RAB9A (0.42) | KCNQ2JAK2JAK1TYK2JAK3 | |
| Ammonia Solution, Strong SCHEMBL25241047 | 0.82 | RAB9A (0.41) | KCNQ2JAK2JAK1TYK2JAK3 | |
| Hydrochloric Acid SCHEMBL31020077 | 0.82 | RAB9A (0.41) | KCNQ2JAK2JAK1TYK2JAK3 | |
| SCHEMBL30487350 | 0.81 | KCNQ2 (0.38) | KCNQ2JAK2JAK1TYK2JAK3 | |
| SCHEMBL25250912 | 0.78 | KCNQ2 (0.62) | KCNQ2JAK2JAK1TYK2JAK3 | |
| SCHEMBL30487400 | 0.78 | KCNQ2 (0.62) | KCNQ2JAK2JAK1TYK2JAK3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024067819-A1 | PIPERIDINE-CONTAINING POLYCYCLIC DERIVATIVE MODULATOR, PREPARATION METHOD THEREFOR, AND USE THEREOF | 上海翰森生物医药科技有限公司 | 2024-04-04 | — | — | WO | disclosed |
| WO-2023125935-A1 | BENZOPYRIDINE DERIVATIVE REGULATOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 上海翰森生物医药科技有限公司 | 2023-07-06 | — | — | WO | disclosed |