Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3A | P46098 | 19/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1004488 | 1.00 | HTR3A (0.47) | HTR3AKCNH2CYP2C19IDO1MAOA | |
| SCHEMBL1006252 | 0.89 | HTR3A (0.47) | HTR3AKCNH2CYP2C19 | |
| SCHEMBL3980956 | 0.84 | HTR3A (0.43) | HTR3AKCNH2CYP2C19 | |
| SCHEMBL1005833 | 0.84 | HTR3A (0.43) | HTR3AKCNH2CYP2C19 | |
| SCHEMBL3981692 | 0.83 | HTR3A (0.43) | HTR3AKCNH2CYP2C19 | |
| SCHEMBL1004932 | 0.83 | HTR3A (0.43) | HTR3AKCNH2CYP2C19 | |
| SCHEMBL1006786 | 0.81 | HTR3A (0.51) | HTR3AKCNH2CYP2C19 | |
| SCHEMBL1006784 | 0.81 | HTR3A (0.75) | HTR3AKCNH2CYP2C19 | |
| Hydrochloric Acid SCHEMBL1006103 | 0.81 | HTR3A (0.74) | HTR3AKCNH2CYP2C19 | |
| Hydrochloric Acid SCHEMBL1006105 | 0.81 | HTR3A (0.51) | HTR3AKCNH2CYP2C19 |
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 |