Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 17/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.61 |
| ▸ | NAMPT | P43490 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL30797875 | 0.86 | HTR6 (0.59) | HTR6CYP3A4CYP2D6NAMPT | |
| SCHEMBL1413320 | 0.86 | HTR6 (0.59) | HTR6CYP3A4CYP2D6NAMPT | |
| SCHEMBL7975063 | 0.82 | HTR6 (0.61) | HTR6CYP3A4CYP2D6 | |
| SCHEMBL1413782 | 0.77 | HTR6 (0.73) | HTR6CYP3A4CYP2D6NAMPTDRD2 | |
| SCHEMBL1413704 | 0.77 | HTR6 (0.56) | HTR6CYP3A4CYP2D6NAMPT | |
| SCHEMBL5353003 | 0.77 | HTR6 (1.00) | HTR6CYP3A4CYP2D6DRD2 | |
| SCHEMBL5356815 | 0.76 | HTR6 (0.77) | HTR6CYP3A4CYP2D6 | |
| SCHEMBL23536650 | 0.73 | HTR6 (0.75) | HTR6CYP3A4CYP2D6DRD2 | |
| SCHEMBL12810410 | 0.72 | ALDH1A1 (0.56) | HTR6CYP3A4CYP2D6L3MBTL1 | |
| Hydrochloric Acid SCHEMBL1413954 | 0.72 | ALDH1A1 (0.55) | HTR6CYP3A4CYP2D6L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009140210-A2 | RADIOTRACERS FOR IMAGING CANNABINOID SUB-TYPE1 (CB1) RECEPTOR | THE GOVERNMENT OF THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2009-11-19 | — | — | WO | disclosed |