Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 15/20 | 0.60 |
| ▸ | SLC6A4 | P31645 | 15/20 | 0.60 |
| ▸ | SLC6A3 | Q01959 | 15/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 9/20 | 0.60 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.37 |
| ▸ | HTR2C | P28335 | 3/20 | 0.37 |
| ▸ | HTR2B | P41595 | 3/20 | 0.37 |
| ▸ | HTR2A | P28223 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5908043 | 0.82 | SLC6A4 (0.55) | SLC6A2SLC6A4SLC6A3CYP2D6ADRB1 | |
| SCHEMBL5631142 | 0.81 | SLC6A2 (0.50) | SLC6A2SLC6A4SLC6A3CYP2D6ADRB1 | |
| SCHEMBL5632263 | 0.81 | SLC6A2 (0.50) | SLC6A2SLC6A4SLC6A3CYP2D6ADRB1 | |
| SCHEMBL5631151 | 0.81 | SLC6A2 (0.50) | SLC6A2SLC6A4SLC6A3CYP2D6ADRB1 | |
| SCHEMBL8907834 | 0.80 | SLC6A2 (0.46) | SLC6A2SLC6A4SLC6A3CYP2D6ADRB1 | |
| SCHEMBL2258781 | 0.75 | SLC6A2 (1.00) | SLC6A2SLC6A4SLC6A3CYP2D6 | |
| SCHEMBL6658178 | 0.74 | SLC6A4 (0.81) | SLC6A2SLC6A4SLC6A3CYP2D6ADRB1 | |
| SCHEMBL22546974 | 0.73 | SLC6A2 (0.59) | SLC6A2SLC6A4SLC6A3CYP2D6ADRB1 | |
| SCHEMBL2155124 | 0.73 | RAD52 (0.46) | SLC6A2SLC6A4SLC6A3HTR2CHTR2B | |
| SCHEMBL5632812 | 0.73 | RAD52 (0.46) | SLC6A2SLC6A4SLC6A3HTR2CHTR2B |
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-5925638-A | Substituted 1-indolylpropyl-4-benzylpiperazine derivatives | MERCK SHARP & DOHME LTD. (GB) | 1999-07-20 | — | — | US | disclosed |