Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR4 | Q13639 | 15/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.32 |
| ▸ | HTR2A | P28223 | 2/20 | 0.32 |
| ▸ | HTR1D | P28221 | 2/20 | 0.32 |
| ▸ | HTR7 | P34969 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | HTR1B | P28222 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5341243 | 0.92 | HTR4 (0.60) | HTR4CYP3A4ACHEKCNH2HTR2A | |
| SCHEMBL5112331 | 0.90 | HTR4 (0.72) | HTR4CYP3A4ACHEKCNH2HTR2A | |
| SCHEMBL5349482 | 0.89 | HTR4 (0.53) | HTR4CYP3A4ACHEKCNH2 | |
| SCHEMBL5116914 | 0.85 | HTR4 (0.70) | HTR4CYP3A4ACHEKCNH2HTR2A | |
| SCHEMBL5394346 | 0.84 | HTR4 (0.55) | HTR4CYP3A4ACHE | |
| SCHEMBL5112304 | 0.84 | HTR4 (0.79) | HTR4CYP3A4ACHEKCNH2 | |
| SCHEMBL5112375 | 0.83 | HTR4 (0.71) | HTR4CYP3A4ACHEKCNH2 | |
| SCHEMBL5122071 | 0.83 | HTR4 (0.71) | HTR4CYP3A4ACHEKCNH2 | |
| SCHEMBL15949468 | 0.82 | HTR4 (0.74) | HTR4CYP3A4ACHEKCNH2HTR2A | |
| SCHEMBL5334028 | 0.82 | HTR4 (0.57) | HTR4CYP3A4ACHE |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1856114-A1 | BENZISOXAZOLE DERIVATIVES | Pfizer, Inc. (US) | 2007-11-21 | — | — | EP | disclosed |
| WO-2006090224-A1 | BENZISOXAZOLE DERIVATIVES | PFIZER JAPAN INC. (JP) | 2006-08-31 | — | — | WO | disclosed |