Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.38 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.38 |
| ▸ | CDK5R1 | Q15078 | 3/20 | 0.38 |
| ▸ | CLK1 | P49759 | 2/20 | 0.38 |
| ▸ | CLK2 | P49760 | 2/20 | 0.38 |
| ▸ | CLK3 | P49761 | 2/20 | 0.38 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.38 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.38 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.36 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.36 |
| ▸ | PDE5A | O76074 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11071485 | 0.80 | LRRK2 (0.39) | LRRK2CDK5CDK5R1CLK1CLK2 | |
| SCHEMBL21560949 | 0.72 | ADORA2A (0.40) | CLK1CCNB2CDK1CCNB1CCNB3 | |
| SCHEMBL11068415 | 0.71 | KDM4E (0.44) | LRRK2CDK5CDK5R1CLK1CLK2 | |
| SCHEMBL11072002 | 0.69 | KDM4D (0.43) | HPGDLMNAALDH1A1KDM4DLIMK1 | |
| SCHEMBL7338498 | 0.68 | PARP1 (0.47) | LRRK2CDK5CDK5R1KDM4EHPGD | |
| SCHEMBL11633151 | 0.68 | G6PD (0.40) | CDK5CDK5R1CCNB2CDK1CCNB1 | |
| SCHEMBL10689563 | 0.67 | DAO (0.59) | LRRK2CDK5CDK5R1CLK1CLK2 | |
| SCHEMBL30421743 | 0.67 | DAO (0.59) | LRRK2KDM4EHPGDPDE3BPDE3A | |
| SCHEMBL10689557 | 0.67 | DAO (0.59) | LRRK2KDM4EHPGDPDE3BPDE3A | |
| SCHEMBL11075196 | 0.67 | KDM4E (0.39) | LRRK2CDK5CDK5R1CLK1CLK2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4474786-A | CONGESTIVE HEART FAILURE | SCHERING CORPORATION (US) | 1984-10-02 | — | — | US | disclosed |
| EP-0102046-A1 | Tricyclic lactams, method for making them, pharmaceutical compositions containing them | SCHERING CORPORATION (US) | 1984-03-07 | — | — | EP | disclosed |