Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR6 | P46095 | 4/20 | 0.37 |
| ▸ | JAK2 | O60674 | 2/20 | 0.35 |
| ▸ | JAK1 | P23458 | 2/20 | 0.35 |
| ▸ | TYK2 | P29597 | 2/20 | 0.35 |
| ▸ | JAK3 | P52333 | 2/20 | 0.35 |
| ▸ | CFTR | P13569 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 4/20 | 0.34 |
| ▸ | NPC1 | O15118 | 4/20 | 0.34 |
| ▸ | RAB9A | P51151 | 4/20 | 0.34 |
| ▸ | MITF | O75030 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | AURKA | O14965 | 1/20 | 0.34 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.34 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL18398203 | 0.90 | GPR6 (0.37) | GPR6JAK2JAK1TYK2JAK3 | |
| SCHEMBL18398365 | 0.87 | CYP1A2 (0.42) | TP53NPC1RAB9AGAAALDH1A1 | |
| SCHEMBL18398424 | 0.85 | GPR6 (0.39) | GPR6CFTRTP53NPC1RAB9A | |
| SCHEMBL18398361 | 0.84 | JAK2 (0.40) | GPR6JAK2JAK1TYK2JAK3 | |
| SCHEMBL18398511 | 0.82 | CYP1A2 (0.43) | JAK2JAK1TYK2JAK3TP53 | |
| SCHEMBL18398299 | 0.80 | PDE4A (0.38) | GPR6CFTRTP53NPC1RAB9A | |
| SCHEMBL18398297 | 0.80 | GPR6 (0.37) | GPR6JAK2JAK1TYK2JAK3 | |
| SCHEMBL18398471 | 0.79 | JAK2 (0.52) | GPR6JAK2JAK1TYK2JAK3 | |
| SCHEMBL18398298 | 0.79 | CYP1A2 (0.46) | TP53NPC1RAB9AGAAALDH1A1 | |
| SCHEMBL18398204 | 0.78 | CYP1A2 (0.40) | TP53NPC1RAB9AGAARPS6KB1 |
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-2017012647-A1 | NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF INFLAMMATORY DISORDERS | GALAPAGOS NV (BE) | 2017-01-26 | — | — | WO | disclosed |