Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 11/20 | 0.51 |
| ▸ | SLC6A3 | Q01959 | 10/20 | 0.51 |
| ▸ | SLC6A2 | P23975 | 9/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.50 |
| ▸ | TACR3 | P29371 | 5/20 | 0.48 |
| ▸ | TACR2 | P21452 | 4/20 | 0.48 |
| ▸ | TACR1 | P25103 | 4/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | CCR5 | P51681 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8300790 | 0.86 | EPHX2 (0.51) | SLC6A4SLC6A3SLC6A2CYP2D6TACR3 | |
| SCHEMBL13345602 | 0.86 | CCR5 (0.51) | SLC6A4SLC6A3SLC6A2CYP2D6TACR3 | |
| SCHEMBL3466847 | 0.86 | CCR5 (0.51) | SLC6A4SLC6A3SLC6A2CYP2D6TACR3 | |
| SCHEMBL8590898 | 0.84 | TACR2 (0.46) | SLC6A4SLC6A3SLC6A2CYP2D6TACR3 | |
| SCHEMBL5201742 | 0.82 | SLC6A2 (0.51) | SLC6A4SLC6A3SLC6A2CYP2D6TACR3 | |
| SCHEMBL6950742 | 0.81 | TACR2 (0.66) | SLC6A4SLC6A3SLC6A2CYP2D6TACR3 | |
| SCHEMBL7955246 | 0.80 | CCR5 (0.49) | SLC6A4SLC6A3SLC6A2CYP2D6TACR3 | |
| SCHEMBL6544379 | 0.80 | CCR5 (0.49) | SLC6A4SLC6A3SLC6A2CYP2D6TACR3 | |
| SCHEMBL5200438 | 0.80 | SLC6A2 (0.51) | SLC6A4SLC6A3SLC6A2CYP2D6TACR3 | |
| SCHEMBL5201929 | 0.79 | SLC6A2 (0.53) | SLC6A4SLC6A3SLC6A2CYP2D6TACR3 |
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 |
|---|---|---|---|---|---|---|---|
| US-5770735-A | Polycyclic amine compounds and their enantiomers, their method of preparation and pharmaceutical compositions in which they are present | ELF SANOFI (FR) | 1998-06-23 | — | — | US | disclosed |