Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | KDM1A | O60341 | 3/20 | 0.37 |
| ▸ | BUB1 | O43683 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 2/20 | 0.35 |
| ▸ | CREBBP | Q92793 | 2/20 | 0.35 |
| ▸ | SRD5A1 | P18405 | 3/20 | 0.35 |
| ▸ | SRD5A2 | P31213 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL23931226 | 1.00 | CYP2C19 (0.39) | CYP2C19CYP3A4CYP2D6KDM1ABUB1 | |
| SCHEMBL23931227 | 1.00 | CYP2C19 (0.39) | CYP2C19CYP3A4CYP2D6KDM1ABUB1 | |
| SCHEMBL16612646 | 1.00 | CYP2C19 (0.39) | CYP2C19CYP3A4CYP2D6KDM1ABUB1 | |
| SCHEMBL23931228 | 1.00 | CYP2C19 (0.39) | CYP2C19CYP3A4CYP2D6KDM1ABUB1 | |
| SCHEMBL16612648 | 1.00 | CYP2C19 (0.39) | CYP2C19CYP3A4CYP2D6KDM1ABUB1 | |
| SCHEMBL16612574 | 0.92 | NPC1 (0.35) | CYP2C19CYP3A4CYP2D6BUB1ALDH1A1 | |
| SCHEMBL30284627 | 0.92 | NPC1 (0.35) | CYP2C19CYP3A4CYP2D6BUB1ALDH1A1 | |
| SCHEMBL16612575 | 0.92 | NPC1 (0.35) | CYP2C19CYP3A4CYP2D6BUB1ALDH1A1 | |
| SCHEMBL23931235 | 0.85 | APP (0.36) | CYP2C19CYP3A4CYP2D6KDM1AMAPT | |
| SCHEMBL23931237 | 0.85 | APP (0.36) | CYP2C19CYP3A4CYP2D6KDM1AMAPT |
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-1212292-B1 | (-)-VERBENONE DERIVATIVES | EUPHAR GROUP SRL (IT) | 2004-01-14 | — | — | EP | disclosed |
| US-6649658-B1 | Water soluble antiinflammatory agents | EUPHAR GROUP SRL (IT) | 2003-11-18 | — | — | US | disclosed |