Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.35 |
| ▸ | PDE1B | Q01064 | 2/20 | 0.34 |
| ▸ | PDE2A | O00408 | 1/20 | 0.34 |
| ▸ | PDE8B | O95263 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | PDE1A | P54750 | 1/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.34 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.34 |
| ▸ | PDE11A | Q9HCR9 | 1/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13409351 | 0.85 | LRRK2 (0.36) | MAOAALDH1A1KDM4EHSD17B10CYP2C19 | |
| SCHEMBL1536585 | 0.84 | MAPK1 (0.44) | MAOAALDH1A1KDM4EHSD17B10CYP2C19 | |
| SCHEMBL8271693 | 0.80 | CYP2C19 (0.43) | MAOAALDH1A1KDM4EHSD17B10CYP2C19 | |
| SCHEMBL8272295 | 0.76 | CYP1A2 (0.48) | ALDH1A1KDM4EHSD17B10CYP2C19CYP1A2 | |
| SCHEMBL12780743 | 0.75 | CYP19A1 (0.48) | ALDH1A1CYP2C19CYP1A2DYRK1APDE1B | |
| SCHEMBL2239481 | 0.74 | TRPA1 (0.37) | ALDH1A1CYP2C19CYP1A2DYRK1AMAPK1 | |
| SCHEMBL30666115 | 0.70 | KDM4E (0.40) | MAOAALDH1A1KDM4EHSD17B10CYP1A2 | |
| SCHEMBL26656449 | 0.70 | KDM4E (0.40) | MAOAALDH1A1KDM4EHSD17B10CYP1A2 | |
| SCHEMBL911419 | 0.69 | CCR4 (0.43) | DYRK1AMAPK1MAPTNFE2L2GRM4 | |
| SCHEMBL11755564 | 0.69 | ALDH1A1 (0.39) | MAOAALDH1A1KDM4EHSD17B10DYRK1A |
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-2006000085-A1 | HEPATITIS C INHIBITOR PEPTIDE ANALOGS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2006-01-05 | — | — | WO | disclosed |