Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.36 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.36 |
| ▸ | MAOB | P27338 | 2/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17533251 | 0.75 | BRD4 (0.40) | BRD4PAX8MAOBMAOAKDM1A | |
| SCHEMBL17533030 | 0.69 | BRD4 (0.38) | BRD4HSD17B2 | |
| SCHEMBL15583215 | 0.67 | BRD4 (0.41) | BRD4ALOX12 | |
| SCHEMBL22480499 | 0.66 | CHEK1 (0.53) | BRD4MAOBKDM1A | |
| SCHEMBL17533367 | 0.65 | PRCP (0.43) | BRD4ALOX12 | |
| SCHEMBL13196859 | 0.64 | BRD4 (0.47) | BRD4KDM4EALDH1A1NPC1ALOX12 | |
| SCHEMBL15142022 | 0.63 | KDM4E (0.46) | BRD4KDM4EALDH1A1ALOX12RAB9A | |
| SCHEMBL30103792 | 0.63 | BRD4 (0.46) | BRD4KDM4EALDH1A1NPC1ALOX12 | |
| SCHEMBL11714775 | 0.63 | PRCP (0.49) | KDM4EALDH1A1KDM1A | |
| SCHEMBL19622906 | 0.63 | BRD4 (0.36) | BRD4ALDH1A1PAX8MAOBMAOA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016028110-A1 | A PLURALITY OF HOST MATERIALS AND AN ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE SAME | ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) | 2016-02-25 | — | — | WO | disclosed |