Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 1/20 | 0.57 |
| ▸ | HTR1D | P28221 | 1/20 | 0.57 |
| ▸ | HTR1B | P28222 | 1/20 | 0.57 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 11/20 | 0.40 |
| ▸ | HTR2A | P28223 | 7/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | HTR2B | P41595 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8613884 | 0.86 | HTR1A (0.59) | HTR1AHTR1DHTR1BUSP2HTR2C | |
| SCHEMBL8613994 | 0.86 | HTR1A (0.57) | HTR1AHTR1DHTR1BUSP2HTR2C | |
| SCHEMBL8615003 | 0.86 | HTR1A (0.66) | HTR1AHTR1DHTR1BHTR2CHTR2A | |
| SCHEMBL8617369 | 0.79 | HTR1D (0.59) | HTR1AHTR1DHTR1BHTR2CHTR2A | |
| SCHEMBL8614116 | 0.79 | HTR1D (0.57) | HTR1AHTR1DHTR1BHTR2CHTR2A | |
| SCHEMBL8616138 | 0.79 | HTR1D (0.57) | HTR1AHTR1DHTR1BHTR2CHTR2A | |
| SCHEMBL8617984 | 0.79 | HTR1D (0.65) | HTR1AHTR1DHTR1BHTR2CHTR2A | |
| SCHEMBL8128007 | 0.74 | HTR1A (0.79) | HTR1AHTR1DHTR1BUSP2HTR2C | |
| SCHEMBL8619486 | 0.74 | HTR1D (0.51) | HTR1AHTR1DHTR1BHTR2CHTR2A | |
| SCHEMBL8119474 | 0.74 | HTR1A (0.82) | HTR1AHTR1DHTR1BUSP2HTR2C |
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-1998050346-A2 | ACETAMIDE AND UREA DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE IN THE TREATMENT OF CNS DISORDERS | SMITHKLINE BEECHAM PLC (GB) | 1998-11-12 | — | — | WO | disclosed |