Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6590403 | 0.73 | TAS1R3 (0.35) | KDM4EMAPTKMT2AATMCYP2D6 | |
| SCHEMBL6971900 | 0.64 | KDM4E (0.31) | KDM4EKMT2A | |
| SCHEMBL9287695 | 0.64 | EPHX1 (0.33) | KDM4EMAPTKMT2AATMCYP2D6 | |
| SCHEMBL17152527 | 0.64 | CYP2C19 (0.38) | — | |
| SCHEMBL5842740 | 0.64 | HTT (0.34) | — | |
| SCHEMBL6592080 | 0.63 | PSEN1 (0.37) | KDM4EMAPTKMT2AATMCYP2D6 | |
| SCHEMBL5363249 | 0.63 | CTSS (0.37) | — | |
| SCHEMBL6206698 | 0.62 | KDM4E (0.38) | KDM4EMAPTKMT2AATMCYP2D6 | |
| SCHEMBL14889774 | 0.62 | CYP2C19 (0.30) | — | |
| SCHEMBL5983633 | 0.62 | CPB2 (0.39) | KDM4EMAPTKMT2AATMCYP2D6 |
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-1539178-A2 | PROTEASE INHIBITORS | SmithKline Beecham Corporation (US) | 2005-06-15 | — | — | EP | disclosed |
| WO-2004017911-A2 | PROTEASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2004-03-04 | — | — | WO | disclosed |