Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 4/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.32 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.32 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.32 |
| ▸ | RORB | Q92753 | 1/20 | 0.31 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.30 |
| ▸ | MTOR | P42345 | 1/20 | 0.30 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9988166 | 0.81 | HTR2A (0.34) | S1PR1SCN9APIK3CAMTOR | |
| SCHEMBL13877375 | 0.78 | S1PR1 (0.38) | RORCS1PR1SCN9AADRB2 | |
| SCHEMBL4550399 | 0.78 | SCN9A (0.39) | S1PR1SCN9A | |
| SCHEMBL18266454 | 0.78 | SCN9A (0.34) | S1PR1SCN9A | |
| Hydrochloric Acid SCHEMBL4225843 | 0.77 | S1PR1 (0.38) | RORCS1PR1SCN9AADRB2 | |
| Hydrochloric Acid SCHEMBL27777869 | 0.77 | S1PR1 (0.38) | RORCS1PR1SCN9AADRB2 | |
| SCHEMBL4550317 | 0.77 | IDH1 (0.43) | SCN9A | |
| SCHEMBL16045149 | 0.77 | IDH1 (0.43) | SCN9A | |
| Hydrochloric Acid SCHEMBL2715279 | 0.77 | SCN9A (0.38) | S1PR1SCN9A | |
| Hydrochloric Acid SCHEMBL2714340 | 0.75 | IDH1 (0.43) | SCN9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1966156-B1 | NEW COMPOUNDS III | ASTRAZENECA AB (SE) | 2011-12-21 | — | — | EP | disclosed |