Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 7/20 | 0.37 |
| ▸ | REN | P00797 | 4/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | F2 | P00734 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | LTA4H | P09960 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | PEPD | P12955 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | HRH1 | P35367 | 1/20 | 0.37 |
| ▸ | THPO | P40225 | 1/20 | 0.37 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL24058502 | 1.00 | ACE (0.37) | ACERENCYP3A4CYP2C9PKM | |
| SCHEMBL24058848 | 0.88 | EPHX2 (0.36) | CYP3A4CYP2C9PKMCYP2C19MAPT | |
| SCHEMBL24058760 | 0.87 | REN (0.39) | ACERENCYP3A4CYP2C9PKM | |
| SCHEMBL18078245 | 0.87 | REN (0.39) | ACERENCYP3A4CYP2C9PKM | |
| SCHEMBL21168279 | 0.83 | ACE (0.43) | ACERENCYP3A4CYP2C9PKM | |
| SCHEMBL21168328 | 0.83 | ACE (0.43) | ACERENCYP3A4CYP2C9PKM | |
| SCHEMBL21168269 | 0.83 | LTA4H (0.47) | ACECYP3A4CYP2C9PKMCYP2C19 | |
| SCHEMBL21168268 | 0.83 | LTA4H (0.47) | ACECYP3A4CYP2C9PKMCYP2C19 | |
| SCHEMBL21168276 | 0.82 | ACE (0.35) | ACERENCYP3A4CYP2C9PKM | |
| SCHEMBL21168332 | 0.82 | ACE (0.35) | ACERENCYP3A4CYP2C9PKM |
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-4023645-A1 | 1,2,4-OXADIAZOLE AND THIADIAZOLE COMPOUNDS AS IMMUNOMODULATORS | Aurigene Discovery Technologies Limited (IN) | 2022-07-06 | — | — | EP | disclosed |
| EP-3267984-B1 | 1,2,4-OXADIAZOLE AND THIADIAZOLE COMPOUNDS AS IMMUNOMODULATORS | AURIGENE DISCOVERY TECH LTD (IN) | 2021-11-24 | — | — | EP | disclosed |