Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE1B | Q01064 | 1/20 | 0.45 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.44 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | LSS | P48449 | 1/20 | 0.41 |
| ▸ | F10 | P00742 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.40 |
| ▸ | POLA1 | P09884 | 1/20 | 0.39 |
| ▸ | AURKA | O14965 | 1/20 | 0.39 |
| ▸ | JAK2 | O60674 | 1/20 | 0.39 |
| ▸ | JAK3 | P52333 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.39 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.38 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6667774 | 0.87 | CHEK1 (0.46) | PDE1BAKR1C3NR1H4NPC1RAB9A | |
| SCHEMBL6667470 | 0.83 | INSR (0.39) | AKR1C3NR1H4NPC1RAB9ALSS | |
| SCHEMBL6667754 | 0.81 | AKR1C3 (0.39) | PDE1BAKR1C3NR1H4NPC1RAB9A | |
| SCHEMBL7014636 | 0.81 | RAB9A (0.38) | NR1H4NPC1RAB9AF10ENPP2 | |
| SCHEMBL7015761 | 0.80 | ALDH1A1 (0.41) | NR1H4NPC1RAB9AF10SMN1; SMN2 | |
| SCHEMBL7478855 | 0.80 | POLA1 (0.39) | PDE1BAKR1C3NR1H4NPC1RAB9A | |
| SCHEMBL7472513 | 0.79 | AKR1C3 (0.36) | PDE1BAKR1C3NR1H4NPC1RAB9A | |
| SCHEMBL7014028 | 0.77 | ALDH1A1 (0.37) | NR1H4NPC1RAB9A | |
| SCHEMBL7475511 | 0.77 | NR1H4 (0.38) | AKR1C3NR1H4NPC1RAB9ALSS | |
| SCHEMBL6669285 | 0.76 | POLA1 (0.35) | AKR1C3NR1H4NPC1RAB9AKCNH2 |
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-1301493-A2 | HETEROCYCLE CARBOXAMIDES AS ANTIVIRAL AGENTS | PHARMACIA & UPJOHN COMPANY (US) | 2003-04-16 | — | — | EP | disclosed |
| WO-2002004444-A2 | HETEROCYCLE CARBOXAMIDES AS ANTIVIRAL AGENTS | PHARMACIA & UPJOHN COMPANY (US) | 2002-01-17 | — | — | WO | disclosed |