Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.32 |
| ▸ | IDH1 | O75874 | 1/20 | 0.31 |
| ▸ | CETP | P11597 | 1/20 | 0.31 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.31 |
| ▸ | BRD7 | Q9NPI1 | 1/20 | 0.31 |
| ▸ | BRD4 | O60885 | 1/20 | 0.30 |
| ▸ | MAPK7 | Q13164 | 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 | |
|---|---|---|---|---|
| SCHEMBL8417200 | 0.85 | KDM4E (0.33) | KDM4EALDH1A1HPGDMAPTHSD17B10 | |
| SCHEMBL8337979 | 0.82 | ALDH1A1 (0.39) | KDM4EALDH1A1HPGDMAPTBRD4 | |
| SCHEMBL8418964 | 0.80 | KDM4E (0.40) | KDM4EALDH1A1HPGDMAPTHSD17B10 | |
| SCHEMBL8337573 | 0.73 | ADORA3 (0.34) | KDM4EALDH1A1HPGDMAPTHSD17B10 | |
| SCHEMBL8339203 | 0.67 | KDM4E (0.37) | KDM4EALDH1A1HPGDMAPTHSD17B10 | |
| SCHEMBL8417093 | 0.66 | BRD4 (0.33) | KDM4EALDH1A1HPGDMAPTHSD17B10 | |
| SCHEMBL8340761 | 0.64 | KDM4E (0.38) | KDM4EALDH1A1HPGDMAPTHSD17B10 | |
| SCHEMBL8300415 | 0.64 | CYP3A4 (0.45) | IDH1BRD4MAPK7 | |
| SCHEMBL8417074 | 0.63 | AKT1 (0.37) | KDM4E | |
| SCHEMBL8338051 | 0.63 | ALDH1A1 (0.46) | KDM4EALDH1A1HPGDMAPTHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-5908841-A | 5,11-dihydro-6H-dipyrido 3,2-b:2',3'-e!azepine-6-ones and their use in the prevention of treatment of HIV infection | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) | 1999-06-01 | — | — | US | disclosed |