Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 14/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 14/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 14/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 8/20 | 0.45 |
| ▸ | FPR2 | P25090 | 1/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 3/20 | 0.36 |
| ▸ | HTR2B | P41595 | 2/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5632263 | 0.80 | SLC6A2 (0.50) | SLC6A2SLC6A4SLC6A3CYP2D6HTR2C | |
| SCHEMBL5631151 | 0.80 | SLC6A2 (0.50) | SLC6A2SLC6A4SLC6A3CYP2D6HTR2C | |
| SCHEMBL5631142 | 0.80 | SLC6A2 (0.50) | SLC6A2SLC6A4SLC6A3CYP2D6HTR2C | |
| SCHEMBL9842266 | 0.80 | SLC6A4 (0.41) | SLC6A2SLC6A4SLC6A3CYP2D6FPR2 | |
| SCHEMBL8472280 | 0.80 | SLC6A2 (0.60) | SLC6A2SLC6A4SLC6A3CYP2D6HTR2C | |
| SCHEMBL9135987 | 0.79 | SLC6A2 (0.44) | SLC6A2SLC6A4SLC6A3CYP2D6ADRB1 | |
| SCHEMBL9842263 | 0.79 | SLC6A4 (0.40) | SLC6A2SLC6A4SLC6A3CYP2D6FPR2 | |
| SCHEMBL10385636 | 0.77 | SLC6A4 (0.66) | SLC6A2SLC6A4SLC6A3CYP2D6ADRB1 | |
| SCHEMBL27977247 | 0.77 | SLC6A4 (0.50) | SLC6A2SLC6A4SLC6A3CYP2D6ADRB1 | |
| SCHEMBL6658178 | 0.75 | SLC6A4 (0.81) | SLC6A2SLC6A4SLC6A3CYP2D6ADRB1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1997017338-A1 | SUBSTITUTED 1-INDOLYLPROPYL-4-BENZYLPIPERAZINE DERIVATIVES | MERCK SHARP & DOHME LIMITED (GB) | 1997-05-15 | — | — | WO | disclosed |