Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3A | P46098 | 17/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | TOP2A | P11388 | 2/20 | 0.45 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.37 |
| ▸ | HCRTR2 | O43614 | 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 | |
|---|---|---|---|---|
| SCHEMBL1005918 | 1.00 | HTR3A (0.52) | HTR3AKCNH2CYP2C19TOP2AHCRTR1 | |
| SCHEMBL3990444 | 0.89 | HTR3A (0.49) | HTR3AKCNH2CYP2C19TOP2A | |
| SCHEMBL1005434 | 0.89 | HTR3A (0.49) | HTR3AKCNH2CYP2C19TOP2A | |
| SCHEMBL1006097 | 0.88 | HTR3A (0.51) | HTR3AKCNH2CYP2C19TOP2A | |
| SCHEMBL3988561 | 0.88 | HTR3A (0.51) | HTR3AKCNH2CYP2C19TOP2A | |
| SCHEMBL1004469 | 0.87 | HTR3A (0.48) | HTR3AKCNH2CYP2C19TOP2AHCRTR2 | |
| SCHEMBL1004355 | 0.87 | HTR3A (0.48) | HTR3AKCNH2CYP2C19TOP2AHCRTR2 | |
| SCHEMBL3984149 | 0.87 | HTR3A (0.50) | HTR3AKCNH2CYP2C19TOP2A | |
| SCHEMBL1005157 | 0.87 | HTR3A (0.48) | HTR3AKCNH2CYP2C19TOP2AHCRTR2 | |
| SCHEMBL1005158 | 0.87 | HTR3A (0.48) | HTR3AKCNH2CYP2C19TOP2AHCRTR2 |
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-2061460-A2 | 2-AMINOBENZOXAZOLE CARBOXAMIDES AS 5HT3 MODULATORS | Albany Molecular Research, Inc. (US) | 2009-05-27 | — | — | EP | disclosed |
| WO-2008019372-A2 | 2-AMINOBENZOXAZOLE CARBOXAMIDES AS 5HT3 MODULATORS | ALBANY MOLECULAR RESEARCH, INC. (US) | 2008-02-14 | — | — | WO | disclosed |