Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2432624 | 1.00 | NR1I2 (0.32) | NR1I2KDM4EHTTATMALDH1A1 | |
| SCHEMBL4796389 | 0.91 | KDM4E (0.33) | NR1I2KDM4EHTTATMALDH1A1 | |
| SCHEMBL4796398 | 0.91 | KDM4E (0.33) | NR1I2KDM4EHTTATMALDH1A1 | |
| SCHEMBL14290668 | 0.89 | CYP2E1 (0.34) | NR1I2KDM4EHTTATMALDH1A1 | |
| SCHEMBL4353778 | 0.89 | NR1I2 (0.41) | NR1I2CYP2E1 | |
| SCHEMBL4353775 | 0.89 | NR1I2 (0.41) | NR1I2CYP2E1 | |
| SCHEMBL2432492 | 0.88 | NR1I2 (0.36) | NR1I2KDM4EHTTATMALDH1A1 | |
| SCHEMBL2432488 | 0.88 | NR1I2 (0.36) | NR1I2KDM4EHTTATMALDH1A1 | |
| SCHEMBL2108455 | 0.88 | NR1I2 (0.32) | NR1I2KDM4EHTTATMALDH1A1 | |
| SCHEMBL2108456 | 0.88 | NR1I2 (0.32) | NR1I2KDM4EHTTATMALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2086966-B1 | 2-CARBOXY THIOPHENE DERIVATIVES AS ANTI VIRAL AGENTS | GLAXOSMITHKLINE LLC (US) | 2011-09-14 | — | — | EP | disclosed |
| EP-2086966-A1 | 2-CARBOXY THIOPHENE DERIVATIVES AS ANTI VIRAL AGENTS | SmithKline Beecham Corporation (US) | 2009-08-12 | — | — | EP | disclosed |
| WO-2008059042-A1 | 2-CARBOXY THIOPHENE DERIVATIVES AS ANTI VIRAL AGENTS | SMITHKLINE BEECHAM CORPORATION (US) | 2008-05-22 | — | — | WO | disclosed |