Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 12/20 | 0.51 |
| ▸ | SLC6A4 | P31645 | 12/20 | 0.51 |
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | SLC9A3 | P48764 | 5/20 | 0.36 |
| ▸ | GRM7 | Q14831 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7419877 | 1.00 | SLC6A2 (0.51) | SLC6A2SLC6A4SLC6A3CYP2D6SLC9A3 | |
| SCHEMBL11932029 | 0.91 | SLC6A2 (0.51) | SLC6A2SLC6A4SLC6A3CYP2D6SLC9A3 | |
| SCHEMBL7422683 | 0.91 | SLC6A2 (0.51) | SLC6A2SLC6A4SLC6A3CYP2D6SLC9A3 | |
| SCHEMBL7417567 | 0.91 | SLC6A2 (0.51) | SLC6A2SLC6A4SLC6A3CYP2D6SLC9A3 | |
| Hydrochloric Acid SCHEMBL7423941 | 0.90 | SLC6A2 (0.50) | SLC6A2SLC6A4SLC6A3CYP2D6SLC9A3 | |
| Hydrochloric Acid SCHEMBL7423946 | 0.90 | SLC6A2 (0.50) | SLC6A2SLC6A4SLC6A3CYP2D6SLC9A3 | |
| Hydrochloric Acid SCHEMBL7423937 | 0.90 | SLC6A2 (0.50) | SLC6A2SLC6A4SLC6A3CYP2D6SLC9A3 | |
| SCHEMBL7375364 | 0.88 | SLC6A2 (0.46) | SLC6A2SLC6A4SLC6A3CYP2D6SLC9A3 | |
| Hydrochloric Acid SCHEMBL7368016 | 0.86 | SLC6A2 (0.46) | SLC6A2SLC6A4SLC6A3CYP2D6SLC9A3 | |
| SCHEMBL8639898 | 0.86 | SLC6A2 (0.53) | SLC6A2SLC6A4SLC6A3CYP2D6SLC9A3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1996002494-A1 | BENZOCYCLOALKYLAMINE DERIVATIVES AS CALCIUM CHANNEL ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1996-02-01 | — | — | WO | claimed |
| WO-1996002494-A1 | BENZOCYCLOALKYLAMINE DERIVATIVES AS CALCIUM CHANNEL ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1996-02-01 | — | — | WO | disclosed |