Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 10/20 | 0.59 |
| ▸ | SLC6A3 | Q01959 | 10/20 | 0.59 |
| ▸ | SLC6A4 | P31645 | 9/20 | 0.59 |
| ▸ | NPC1 | O15118 | 1/20 | 0.57 |
| ▸ | RAB9A | P51151 | 1/20 | 0.57 |
| ▸ | SLC9A3 | P48764 | 1/20 | 0.50 |
| ▸ | DRD2 | P14416 | 1/20 | 0.49 |
| ▸ | DRD1 | P21728 | 1/20 | 0.49 |
| ▸ | RGS12 | O14924 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | HTR2A | P28223 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | HRH1 | P35367 | 1/20 | 0.47 |
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 SCHEMBL11126431 | 0.99 | SLC6A2 (0.58) | SLC6A2SLC6A3SLC6A4NPC1RAB9A | |
| SCHEMBL11098069 | 0.88 | SLC6A2 (0.72) | SLC6A2SLC6A3SLC6A4NPC1RAB9A | |
| Bromide SCHEMBL11105104 | 0.87 | SLC6A2 (0.71) | SLC6A2SLC6A3SLC6A4NPC1RAB9A | |
| Bromide SCHEMBL11274611 | 0.86 | SLC6A2 (0.69) | SLC6A2SLC6A3SLC6A4NPC1RAB9A | |
| SCHEMBL11100674 | 0.85 | NPC1 (0.57) | SLC6A2SLC6A3SLC6A4NPC1RAB9A | |
| SCHEMBL4035350 | 0.85 | SLC6A2 (0.70) | SLC6A2SLC6A3SLC6A4NPC1RAB9A | |
| Bromide SCHEMBL11258851 | 0.84 | SLC6A2 (0.68) | SLC6A2SLC6A3SLC6A4NPC1RAB9A | |
| Bromide SCHEMBL11107064 | 0.82 | NPC1 (0.55) | SLC6A2SLC6A3SLC6A4NPC1RAB9A | |
| SCHEMBL11098022 | 0.82 | NPC1 (0.55) | SLC6A2SLC6A3SLC6A4NPC1RAB9A | |
| Bromide SCHEMBL11099293 | 0.81 | NPC1 (0.54) | SLC6A2SLC6A3SLC6A4NPC1RAB9A |
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-0040956-B1 | 8-SUBSTITUTED 4-(3,4-DIHYDROXYPHENYL)-1,2,3,4-TETRAHYDROISOQUINOLINES | SMITHKLINE BECKMAN CORPORATION (US) | 1984-10-31 | — | — | EP | claimed |