Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 11/20 | 0.40 |
| ▸ | NQO2 | P16083 | 2/20 | 0.35 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.35 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.35 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | HTR5A | P47898 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20170869 | 0.84 | HTR1A (0.33) | HTR1A | |
| SCHEMBL20170772 | 0.84 | HTR1A (0.33) | HTR1A | |
| SCHEMBL20170592 | 0.82 | MTNR1A (0.40) | NQO2MTNR1AMTNR1BHCRTR1CYP1A2 | |
| SCHEMBL20170650 | 0.81 | HCRTR1 (0.44) | HTR1AHCRTR1ADRA1B | |
| SCHEMBL20170652 | 0.79 | OPRM1 (0.37) | NQO2MTNR1AMTNR1BHCRTR1 | |
| SCHEMBL20170728 | 0.79 | OPRM1 (0.37) | NQO2MTNR1AMTNR1BHCRTR1 | |
| SCHEMBL20170607 | 0.79 | OPRM1 (0.37) | NQO2MTNR1AMTNR1BHCRTR1 | |
| SCHEMBL20170880 | 0.77 | HCRTR1 (0.45) | HTR1AHCRTR1 | |
| SCHEMBL20170612 | 0.77 | ADRA1A (0.35) | HTR1ADRD2DRD3 | |
| SCHEMBL20170605 | 0.77 | ADRA1A (0.35) | HTR1ADRD2DRD3 |
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-2453895-B1 | (+) - MORPHINANS AS ANTAGONISTS OF TOLL-LIKE RECEPTOR 9 AND THERAPEUTIC USES THEREOF | MALLINCKRODT LLC (US) | 2018-05-23 | — | — | EP | disclosed |