Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 10/20 | 0.58 |
| ▸ | PARP1 | P09874 | 2/20 | 0.42 |
| ▸ | KDM1A | O60341 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | CRHBP | P24387 | 1/20 | 0.38 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.38 |
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 | 0.97 | SIGMAR1 (0.57) | SIGMAR1PARP1KDM1APOLBSLC6A2 | |
| SCHEMBL1739916 | 0.87 | SIGMAR1 (0.62) | SIGMAR1HTR2B | |
| SCHEMBL1738593 | 0.79 | SIGMAR1 (0.46) | SIGMAR1PARP1KDM1APOLBCRHBP | |
| SCHEMBL1738602 | 0.73 | SIGMAR1 (0.61) | SIGMAR1HTR2B | |
| SCHEMBL1740562 | 0.73 | SIGMAR1 (0.76) | SIGMAR1HTR2B | |
| SCHEMBL1738503 | 0.73 | SIGMAR1 (1.00) | SIGMAR1 | |
| SCHEMBL1740599 | 0.70 | SIGMAR1 (0.60) | SIGMAR1POLBHTR2B | |
| SCHEMBL1737430 | 0.70 | SIGMAR1 (1.00) | SIGMAR1 | |
| SCHEMBL27205423 | 0.67 | PRKDC (0.51) | SLC6A2SLC6A4 | |
| SCHEMBL9380372 | 0.64 | HTR1A (0.50) | SIGMAR1SLC6A4 |
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 |