Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 11/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7881273 | 0.94 | HTR1A (0.53) | HTR1ASLC6A4ACHESLC6A2SLC6A3 | |
| SCHEMBL7877114 | 0.91 | NPC1 (0.49) | HTR1ANPC1SLC6A4ACHE | |
| SCHEMBL7878911 | 0.90 | CCR3 (0.49) | HTR1ANPC1 | |
| SCHEMBL7879009 | 0.90 | HTR1A (0.55) | HTR1ANPC1SLC6A4 | |
| SCHEMBL7075871 | 0.89 | HTR1A (0.43) | HTR1A | |
| SCHEMBL7879034 | 0.85 | HTR1A (0.55) | HTR1ASLC6A4 | |
| SCHEMBL7082018 | 0.84 | HTR1A (0.48) | HTR1A | |
| SCHEMBL7880274 | 0.84 | HTR1A (0.55) | HTR1ASLC6A4ACHE | |
| SCHEMBL7880351 | 0.83 | HTR1A (0.54) | HTR1ASLC6A4 | |
| SCHEMBL7881308 | 0.83 | ADRA2A (0.58) | HTR1ASLC6A4 |
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-6333339-B1 | CENTRAL SYSTEM DISORDERS, SCHIZOPHRENIA AND COGNITION ACTIVATORS | MERCK PATENT GELLSCHAFT MIT BESCHRANKTER (DE) | 2001-12-25 | — | — | US | disclosed |