Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.31 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.31 |
| ▸ | OPRM1 | P35372 | 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 | |
|---|---|---|---|---|
| SCHEMBL4824071 | 0.93 | KDM4E (0.36) | KDM4EHTTATMPDE4D | |
| SCHEMBL4824077 | 0.93 | KDM4E (0.36) | KDM4EHTTATMPDE4D | |
| SCHEMBL4815926 | 0.93 | CYP2E1 (0.36) | CYP2E1OPRM1 | |
| SCHEMBL4757713 | 0.90 | KDM4E (0.32) | KDM4EHTTATMCYP2E1 | |
| SCHEMBL4143061 | 0.86 | KDM4E (0.33) | KDM4EHTTATM | |
| SCHEMBL4789894 | 0.86 | CYP2E1 (0.36) | PDE4DCYP2E1OPRM1 | |
| SCHEMBL4789893 | 0.86 | CYP2E1 (0.36) | PDE4DCYP2E1OPRM1 | |
| SCHEMBL4155397 | 0.84 | KDM4E (0.38) | KDM4EHTTATMPDE4D | |
| SCHEMBL4155399 | 0.84 | KDM4E (0.38) | KDM4EHTTATMPDE4D | |
| SCHEMBL4828339 | 0.83 | KDM4E (0.36) | KDM4EHTTATMPDE4DCYP2E1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009000818-A1 | 3-CARBONYLAMINOTHIOPHENE-2-CARBOXYLIC ACIDS AS HEPATITIS C VIRUS INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2008-12-31 | — | — | WO | disclosed |
| WO-2009000818-A1 | 3-CARBONYLAMINOTHIOPHENE-2-CARBOXYLIC ACIDS AS HEPATITIS C VIRUS INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2008-12-31 | — | — | WO | disclosed |