Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK3 | P52333 | 6/20 | 0.69 |
| ▸ | MELK | Q14680 | 2/20 | 0.69 |
| ▸ | JAK1 | P23458 | 2/20 | 0.62 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.54 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.54 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.53 |
| ▸ | MAP2K4 | P45985 | 1/20 | 0.53 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.53 |
| ▸ | AXL | P30530 | 1/20 | 0.49 |
| ▸ | MERTK | Q12866 | 1/20 | 0.49 |
| ▸ | CDK8 | P49336 | 2/20 | 0.48 |
| ▸ | JAK2 | O60674 | 1/20 | 0.47 |
| ▸ | BRAF | P15056 | 2/20 | 0.47 |
| ▸ | BTK | Q06187 | 5/20 | 0.46 |
| ▸ | CIT | O14578 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL28080559 | 0.85 | JAK3 (0.74) | JAK3MELKJAK1ROCK2CYP3A4 | |
| SCHEMBL28348684 | 0.81 | JAK3 (0.69) | JAK3MELKJAK1ROCK2CYP3A4 | |
| SCHEMBL28080561 | 0.77 | JAK3 (0.62) | JAK3MELKJAK1RPS6KA5MAP2K4 | |
| SCHEMBL30281597 | 0.77 | JAK3 (0.73) | JAK3MELKJAK1ROCK2CYP3A4 | |
| SCHEMBL28348803 | 0.77 | JAK3 (1.00) | JAK3MELKJAK1RPS6KA5MAP2K4 | |
| SCHEMBL21409411 | 0.77 | JAK3 (0.73) | JAK3MELKJAK1ROCK2CYP3A4 | |
| SCHEMBL24804956 | 0.77 | JAK3 (0.72) | JAK3MELKJAK1ROCK2CYP3A4 | |
| SCHEMBL15032775 | 0.77 | JAK3 (0.72) | JAK3JAK1JAK2 | |
| SCHEMBL27387789 | 0.76 | BTK (0.65) | JAK3MELKJAK1ROCK2CYP3A4 | |
| SCHEMBL13695635 | 0.75 | BTK (0.47) | JAK3MELKJAK1RPS6KA5MAP2K4 |
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 |