Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | EHMT2 | Q96KQ7 | 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 | |
|---|---|---|---|---|
| SCHEMBL23995516 | 0.87 | KDM4E (0.31) | KDM4E | |
| SCHEMBL19783894 | 0.84 | KDM4E (0.35) | KDM4EALDH1A1 | |
| SCHEMBL23480264 | 0.83 | PDCD1 (0.35) | — | |
| SCHEMBL10639698 | 0.78 | — | — | |
| SCHEMBL6625522 | 0.78 | — | — | |
| SCHEMBL2012671 | 0.78 | VNN1 (0.33) | OPRM1KDM4EALDH1A1 | |
| SCHEMBL19045071 | 0.78 | — | — | |
| SCHEMBL9060316 | 0.77 | OPRM1 (0.34) | DRD4OPRM1 | |
| SCHEMBL12535978 | 0.76 | KDM4E (0.38) | KDM4EALDH1A1 | |
| SCHEMBL17734308 | 0.76 | KDM4E (0.32) | KDM4EALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0417631-A2 | Condensed diazepinones, process for their preparation, and medicaments containing these compounds | Dr. Karl Thomae GmbH (DE) | 1991-03-20 | — | — | EP | disclosed |