Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 4/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | USP2 | O75604 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 4/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | JAK3 | P52333 | 9/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL20184594 | 0.90 | JAK3 (0.43) | MEN1KMT2AUSP2MAPTALDH1A1 | |
| SCHEMBL20184694 | 0.89 | JAK3 (0.47) | CYP3A4CYP2D6CYP2C19HSD17B10JAK3 | |
| SCHEMBL20184584 | 0.88 | JAK3 (0.59) | JAK3JAK2JAK1 | |
| SCHEMBL16245166 | 0.87 | JAK3 (0.58) | JAK3JAK2JAK1 | |
| SCHEMBL20184567 | 0.87 | JAK3 (0.58) | JAK3JAK2JAK1 | |
| SCHEMBL20184521 | 0.86 | JAK3 (0.59) | JAK3JAK2JAK1 | |
| SCHEMBL20184508 | 0.86 | JAK3 (0.59) | JAK3JAK2JAK1 | |
| SCHEMBL20184424 | 0.86 | JAK3 (0.59) | JAK3JAK2JAK1 | |
| SCHEMBL20184685 | 0.86 | JAK3 (0.59) | JAK3JAK2JAK1 | |
| SCHEMBL20184542 | 0.86 | JAK3 (0.48) | JAK3JAK2JAK1 |
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 |