Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 6/20 | 0.46 |
| ▸ | JAK2 | O60674 | 2/20 | 0.46 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.43 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.41 |
| ▸ | CDK7 | P50613 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | LSS | P48449 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 2/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.39 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7007040 | 0.87 | PDE1B (0.45) | CHEK1JAK2AKR1C3NR1H4NPC1 | |
| SCHEMBL6667754 | 0.83 | AKR1C3 (0.39) | CHEK1AKR1C3NR1H4HSP90AA1HSP90AB1 | |
| SCHEMBL6673044 | 0.83 | ALDH1A1 (0.61) | JAK2AKR1C3KDM4EALDH1A1GLA | |
| SCHEMBL6672697 | 0.83 | JAK2 (0.40) | CHEK1JAK2AKR1C3KDM4EGAA | |
| SCHEMBL7483549 | 0.83 | HSP90AA1 (0.44) | NR1H4ALDH1A1GAAHSP90AA1NPC1 | |
| SCHEMBL6670245 | 0.82 | FLT3 (0.40) | CHEK1JAK2AKR1C3KDM4EALDH1A1 | |
| SCHEMBL6667470 | 0.82 | INSR (0.39) | AKR1C3NR1H4NPC1RAB9ALSS | |
| SCHEMBL7478855 | 0.82 | POLA1 (0.39) | CHEK1AKR1C3NR1H4NPC1RAB9A | |
| SCHEMBL6672201 | 0.82 | JAK2 (0.39) | CHEK1JAK2AKR1C3KDM4EALDH1A1 | |
| SCHEMBL7472513 | 0.81 | AKR1C3 (0.36) | CHEK1AKR1C3NR1H4NPC1RAB9A |
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-2004019940-A1 | METHOD OF PREVENTING OR TREATING ATHEROSCLEROSIS OR RESTENOSIS | PHARMACIA & UPJOHN COMPANY (US) | 2004-03-11 | — | — | WO | claimed |