Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3C3 | Q8NEB9 | 4/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.32 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2487633 | 0.89 | PIK3C3 (0.40) | PIK3C3IDO1PDE10ACYP17A1 | |
| SCHEMBL3509699 | 0.89 | CYP17A1 (0.35) | PIK3C3IDO1PDE10ACYP17A1 | |
| SCHEMBL22655962 | 0.82 | SMN1; SMN2 (0.39) | PIK3C3PDE10ACYP17A1 | |
| SCHEMBL22655945 | 0.82 | PIK3C3 (0.36) | PIK3C3IDO1PDE10ACYP17A1 | |
| SCHEMBL1221785 | 0.82 | SMN1; SMN2 (0.35) | PIK3C3CYP17A1 | |
| SCHEMBL28059106 | 0.82 | PIK3CD (0.33) | PIK3C3CYP17A1 | |
| SCHEMBL27762686 | 0.80 | SMN1; SMN2 (0.41) | PIK3C3 | |
| SCHEMBL28059198 | 0.80 | SMN1; SMN2 (0.38) | — | |
| SCHEMBL25147486 | 0.77 | PIK3CA (0.38) | PIK3C3 | |
| SCHEMBL22932942 | 0.77 | USP7 (0.44) | — |
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-2166846-A1 | INHIBITORS OF JANUS KINASES | Merck Sharp & Dohme Corp. (US) | 2010-03-31 | — | — | EP | disclosed |
| WO-2008156726-A1 | INHIBITORS OF JANUS KINASES | MERCK & CO., INC. (US) | 2008-12-24 | — | — | WO | disclosed |