Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F11 | P03951 | 1/20 | 0.43 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.43 |
| ▸ | XDH | P47989 | 1/20 | 0.43 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.43 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.43 |
| ▸ | LRRK2 | Q5S007 | 5/20 | 0.41 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.41 |
| ▸ | IKBKB | O14920 | 3/20 | 0.40 |
| ▸ | CHUK | O15111 | 3/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | SGK1 | O00141 | 1/20 | 0.39 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.39 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.39 |
| ▸ | JAK2 | O60674 | 1/20 | 0.39 |
| ▸ | JAK3 | P52333 | 1/20 | 0.39 |
| ▸ | GRK6 | P43250 | 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 | |
|---|---|---|---|---|
| SCHEMBL20184329 | 0.87 | HSP90AB1 (0.46) | HSP90AB1IKBKBCHUKGRIA2GRIA4 | |
| SCHEMBL20184548 | 0.85 | JAK3 (0.53) | IKBKBCHUKSGK1JAK2JAK3 | |
| SCHEMBL20184551 | 0.85 | JAK3 (0.53) | PIN1JAK2JAK3 | |
| SCHEMBL20184525 | 0.84 | JAK2 (0.49) | CHUKSGK1JAK2JAK3 | |
| SCHEMBL20184532 | 0.84 | PRKD1 (0.40) | HSP90AB1JAK2JAK3 | |
| SCHEMBL20184599 | 0.84 | JAK3 (0.53) | PIN1HSP90AB1CHUKSGK1JAK2 | |
| SCHEMBL20184581 | 0.84 | JAK3 (0.43) | JAK2JAK3 | |
| SCHEMBL20184478 | 0.84 | JAK2 (0.53) | PIN1JAK2JAK3 | |
| SCHEMBL20184522 | 0.84 | JAK3 (0.37) | LRRK2HSP90AB1IKBKBCHUKJAK2 | |
| SCHEMBL20184688 | 0.83 | JAK3 (0.43) | JAK2JAK3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2788000-B1 | PYRROLOPYRIMIDINES AS JANUS KINASE INHIBITORS | MERCK SHARP & DOHME (US) | 2018-05-30 | — | — | EP | claimed |