Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.36 |
| ▸ | EDNRA | P25101 | 1/20 | 0.31 |
| ▸ | ERN1 | O75460 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.30 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL1807044 | 0.82 | CYP1A2 (0.36) | ERN1CYP1A2CYP3A4CYP2C8CYP2C9 | |
| SCHEMBL1842089 | 0.81 | CYP1A2 (0.37) | CYP1A2CYP3A4CYP2C9CYP2C19KDM4E | |
| SCHEMBL1806341 | 0.79 | TRPV1 (0.37) | TRPV1SLC6A4CYP1A2CYP3A4KDM4E | |
| SCHEMBL1808007 | 0.78 | KDM4E (0.34) | CYP1A2CYP3A4CYP2C8CYP2C9CYP2C19 | |
| SCHEMBL1803650 | 0.78 | MEN1 (0.37) | TRPV1ERN1KDM4EALDH1A1 | |
| SCHEMBL1807207 | 0.78 | ERN1 (0.34) | TRPV1ERN1 | |
| SCHEMBL1809432 | 0.78 | ALDH1A1 (0.33) | EDNRASLC6A2SLC6A4KDM4EALDH1A1 | |
| SCHEMBL1810225 | 0.77 | P2RX7 (0.36) | EDNRASLC6A2SLC6A4SLC6A3CYP3A4 | |
| SCHEMBL1805935 | 0.75 | PDE4D (0.46) | TRPV1KDM4EALDH1A1HPGDTSHR | |
| SCHEMBL1805952 | 0.73 | DRD1 (0.39) | ERN1SLC6A2SLC6A4SLC6A3 |
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-2501703-A1 | SPIROPIPERIDINE COMPOUNDS AS ORL-1 RECEPTOR ANTAGONISTS | Eli Lilly and Company (US) | 2012-09-26 | — | — | EP | disclosed |
| WO-2011060035-A1 | SPIROPIPERIDINE COMPOUNDS AS ORL-1 RECEPTOR ANTAGONISTS | ELI LILLY AND COMPANY (US) | 2011-05-19 | — | — | WO | disclosed |