Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 16/20 | 0.67 |
| ▸ | SLC6A4 | P31645 | 16/20 | 0.67 |
| ▸ | SLC6A3 | Q01959 | 16/20 | 0.67 |
| ▸ | NPC1 | O15118 | 1/20 | 0.63 |
| ▸ | RAB9A | P51151 | 1/20 | 0.63 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL11268045 | 0.99 | SLC6A2 (0.65) | SLC6A2SLC6A4SLC6A3NPC1RAB9A | |
| SCHEMBL11098069 | 0.82 | SLC6A2 (0.72) | SLC6A2SLC6A4SLC6A3NPC1RAB9A | |
| SCHEMBL4310238 | 0.81 | SLC6A2 (0.70) | SLC6A2SLC6A4SLC6A3CYP2D6 | |
| Bromide SCHEMBL11105104 | 0.81 | SLC6A2 (0.71) | SLC6A2SLC6A4SLC6A3NPC1RAB9A | |
| SCHEMBL5635531 | 0.80 | SLC6A2 (1.00) | SLC6A2SLC6A4SLC6A3CYP2D6 | |
| SCHEMBL5246719 | 0.80 | SLC6A2 (1.00) | SLC6A2SLC6A4SLC6A3CYP2D6 | |
| SCHEMBL5635210 | 0.80 | SLC6A2 (1.00) | SLC6A2SLC6A4SLC6A3CYP2D6 | |
| SCHEMBL4032877 | 0.80 | SLC6A2 (0.78) | SLC6A2SLC6A4SLC6A3CYP2D6 | |
| SCHEMBL4032379 | 0.80 | SLC6A2 (1.00) | SLC6A2SLC6A4SLC6A3CYP2D6 | |
| Bromide SCHEMBL11274611 | 0.80 | SLC6A2 (0.69) | SLC6A2SLC6A4SLC6A3NPC1RAB9A |
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-4340600-A | Renal dilating methods and compositions using 4-(3,4-dihydroxyphenyl)-1,2,3,4-tetrahydroisoquinolines | SMITHKLINE CORPORATION (US) | 1982-07-20 | — | — | US | disclosed |