Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 16/20 | 0.56 |
| ▸ | SLC6A4 | P31645 | 16/20 | 0.56 |
| ▸ | SLC6A3 | Q01959 | 16/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | DRD1 | P21728 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11216783 | 0.90 | SLC6A4 (0.56) | SLC6A2SLC6A4SLC6A3CYP2D6DRD1 | |
| Hydrochloric Acid SCHEMBL11216338 | 0.89 | SLC6A4 (0.55) | SLC6A2SLC6A4SLC6A3CYP2D6DRD1 | |
| SCHEMBL11215415 | 0.88 | SLC6A2 (0.44) | SLC6A2SLC6A4SLC6A3CYP2D6DRD1 | |
| SCHEMBL11212564 | 0.87 | SLC6A2 (0.54) | SLC6A2SLC6A4SLC6A3CYP2D6DRD1 | |
| Hydrochloric Acid SCHEMBL11216803 | 0.86 | SLC6A2 (0.52) | SLC6A2SLC6A4SLC6A3CYP2D6DRD1 | |
| SCHEMBL10999940 | 0.84 | SLC6A4 (0.57) | SLC6A2SLC6A4SLC6A3CYP2D6DRD1 | |
| SCHEMBL11050238 | 0.83 | NPC1 (0.68) | SLC6A2SLC6A4SLC6A3DRD1NPC1 | |
| Bromide SCHEMBL11038664 | 0.82 | NPC1 (0.67) | SLC6A2SLC6A4SLC6A3DRD1NPC1 | |
| SCHEMBL10999076 | 0.81 | SLC6A4 (0.53) | SLC6A2SLC6A4SLC6A3CYP2D6DRD1 | |
| SCHEMBL11037531 | 0.81 | NPC1 (0.43) | SLC6A2SLC6A4SLC6A3CYP2D6NPC1 |
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-4322423-A | 4-Phenyl-4,5,6,7-tetrahydro-thieno(2,3-C)pyridines and salts thereof | BOEHRINGER INGELHEIM GMBH (DE) | 1982-03-30 | — | — | US | disclosed |