Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 18/20 | 0.62 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1738636 | 0.88 | SIGMAR1 (0.57) | SIGMAR1HTR2BLMNA | |
| SCHEMBL1740580 | 0.87 | SIGMAR1 (0.58) | SIGMAR1HTR2B | |
| SCHEMBL1737439 | 0.77 | SIGMAR1 (1.00) | SIGMAR1KCNH2HTR2B | |
| SCHEMBL1739361 | 0.74 | SIGMAR1 (0.75) | SIGMAR1KCNH2HTR2B | |
| SCHEMBL9978613 | 0.73 | SIGMAR1 (0.74) | SIGMAR1KCNH2HTR2B | |
| SCHEMBL1737898 | 0.73 | SIGMAR1 (1.00) | SIGMAR1KCNH2 | |
| SCHEMBL1738593 | 0.70 | SIGMAR1 (0.46) | SIGMAR1KCNH2ALDH1A1LMNA | |
| SCHEMBL9978430 | 0.70 | SIGMAR1 (0.68) | SIGMAR1KCNH2 | |
| SCHEMBL9978406 | 0.68 | SIGMAR1 (1.00) | SIGMAR1KCNH2ALDH1A1 | |
| SCHEMBL1738639 | 0.68 | SIGMAR1 (0.98) | SIGMAR1KCNH2ALDH1A1 |
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-2395003-A1 | Pyrazole compounds as sigma receptor inhibitors | Laboratorios Del. Dr. Esteve, S.A. (ES) | 2011-12-14 | — | — | EP | claimed |
| EP-2395003-A1 | Pyrazole compounds as sigma receptor inhibitors | Laboratorios Del. Dr. Esteve, S.A. (ES) | 2011-12-14 | — | — | EP | disclosed |