Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 14/20 | 0.85 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.85 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.85 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.85 |
| ▸ | TP53 | P04637 | 1/20 | 0.85 |
| ▸ | TSHR | P16473 | 1/20 | 0.85 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.85 |
| ▸ | HTR2A | P28223 | 3/20 | 0.70 |
| ▸ | HTR2B | P41595 | 3/20 | 0.70 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.70 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.70 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.70 |
| ▸ | DRD3 | P35462 | 2/20 | 0.70 |
| ▸ | LMNA | P02545 | 1/20 | 0.70 |
| ▸ | MAPT | P10636 | 1/20 | 0.70 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.70 |
| ▸ | USP2 | O75604 | 2/20 | 0.65 |
| ▸ | HTR2C | P28335 | 2/20 | 0.65 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.65 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.65 |
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 | |
|---|---|---|---|---|
| SCHEMBL12648288 | 0.92 | SIGMAR1 (1.00) | SIGMAR1CYP3A4CYP1A2CYP2D6TP53 | |
| Hydrochloric Acid SCHEMBL8091253 | 0.91 | SIGMAR1 (0.97) | SIGMAR1CYP3A4CYP1A2CYP2D6TP53 | |
| SCHEMBL14291920 | 0.86 | SIGMAR1 (0.78) | SIGMAR1CYP3A4CYP1A2CYP2D6TP53 | |
| SCHEMBL9156429 | 0.86 | SIGMAR1 (0.74) | SIGMAR1CYP3A4CYP1A2CYP2D6TP53 | |
| SCHEMBL19001393 | 0.86 | SIGMAR1 (0.74) | SIGMAR1CYP3A4CYP1A2CYP2D6TP53 | |
| SCHEMBL24141657 | 0.86 | SIGMAR1 (0.78) | SIGMAR1CYP3A4CYP1A2CYP2D6TP53 | |
| SCHEMBL9472690 | 0.86 | SIGMAR1 (0.74) | SIGMAR1CYP3A4CYP1A2CYP2D6TP53 | |
| SCHEMBL9248064 | 0.86 | SIGMAR1 (0.74) | SIGMAR1CYP3A4CYP1A2CYP2D6TP53 | |
| SCHEMBL6422930 | 0.84 | SIGMAR1 (0.72) | SIGMAR1CYP3A4CYP1A2CYP2D6TP53 | |
| Hydrochloric Acid SCHEMBL4685694 | 0.84 | SIGMAR1 (0.76) | SIGMAR1CYP3A4CYP1A2CYP2D6TP53 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3829558-A1 | METHOD FOR TREATING EPILEPSY | Xenon Pharmaceuticals Inc. (CA) | 2021-06-09 | — | — | EP | disclosed |
| WO-2020023923-A1 | METHOD FOR TREATING EPILEPSY | XENON PHARMACEUTICALS INC. (CA) | 2020-01-30 | — | — | WO | disclosed |