Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.69 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.59 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL15767967 | 0.84 | SLC6A3 (0.79) | SLC6A3SLC6A4 | |
| SCHEMBL7302397 | 0.82 | SLC6A3 (0.68) | SLC6A3 | |
| Hydrochloric Acid SCHEMBL7321944 | 0.81 | SLC6A3 (0.67) | SLC6A3 | |
| SCHEMBL9561754 | 0.79 | SLC6A3 (0.63) | SLC6A3SLC6A4 | |
| SCHEMBL8825473 | 0.77 | SLC6A3 (0.56) | SLC6A3SLC6A4 | |
| SCHEMBL1334144 | 0.75 | DRD2 (0.69) | SLC6A3SLC6A4 | |
| Hydrochloric Acid SCHEMBL7406256 | 0.74 | CCR3 (0.79) | — | |
| SCHEMBL16226670 | 0.74 | SLC6A3 (1.00) | SLC6A3SLC6A4 | |
| SCHEMBL8825359 | 0.74 | ACHE (0.60) | SLC6A3SLC6A4 | |
| SCHEMBL466899 | 0.74 | SIGMAR1 (0.68) | — |
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-1734948-B1 | TRI-SUBSTITUED 2-BENZHYDRYL-5-BENZYLAMINO-TETRAHYDRO-PYRAN-4-OL AND 6-BENZHYDRYL-4-BENZYLAMINO-TETRAHYDRO-PYRAN-3-OL ANALOGUES, AND NOVEL 3,6-DISUBSTITUTED PYRAN DERIVATIVES | UNIV WAYNE STATE (US) | 2014-06-11 | — | — | EP | disclosed |