Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3A | P46098 | 16/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | TOP2A | P11388 | 2/20 | 0.41 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL1004568 | 1.00 | HTR3A (0.50) | HTR3AKCNH2CYP2C19TOP2ARIPK1 | |
| SCHEMBL3988561 | 0.99 | HTR3A (0.51) | HTR3AKCNH2CYP2C19TOP2AKDM4E | |
| SCHEMBL1006097 | 0.99 | HTR3A (0.51) | HTR3AKCNH2CYP2C19TOP2AKDM4E | |
| SCHEMBL3984177 | 0.89 | HTR3A (0.50) | HTR3AKCNH2CYP2C19ALDH1A1 | |
| SCHEMBL1004744 | 0.89 | HTR3A (0.50) | HTR3AKCNH2CYP2C19ALDH1A1 | |
| SCHEMBL3990446 | 0.88 | HTR3A (0.51) | HTR3AKCNH2CYP2C19 | |
| SCHEMBL1005990 | 0.88 | HTR3A (0.51) | HTR3AKCNH2CYP2C19 | |
| SCHEMBL3984963 | 0.87 | HTR3A (0.52) | HTR3AKCNH2CYP2C19TOP2A | |
| SCHEMBL1005918 | 0.87 | HTR3A (0.52) | HTR3AKCNH2CYP2C19TOP2A | |
| SCHEMBL1005434 | 0.84 | HTR3A (0.49) | HTR3AKCNH2CYP2C19TOP2A |
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 |