Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 11/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 5/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.33 |
| ▸ | NCOR2 | Q9Y618 | 4/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | JAK2 | O60674 | 2/20 | 0.32 |
| ▸ | JAK1 | P23458 | 3/20 | 0.32 |
| ▸ | JAK3 | P52333 | 3/20 | 0.32 |
| ▸ | TYK2 | P29597 | 2/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | F2 | P00734 | 1/20 | 0.30 |
| ▸ | F10 | P00742 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22564663 | 0.96 | HDAC1 (0.34) | HDAC1HDAC3HDAC2NCOR2KDM4E | |
| SCHEMBL22563017 | 0.92 | HDAC1 (0.37) | HDAC1HDAC3HDAC2NCOR2KDM4E | |
| SCHEMBL22564672 | 0.92 | HDAC1 (0.35) | HDAC1JAK2JAK1JAK3TYK2 | |
| SCHEMBL22563185 | 0.78 | HDAC1 (0.33) | HDAC1HDAC3HDAC2KDM4EALDH1A1 | |
| SCHEMBL22563186 | 0.78 | JAK1 (0.37) | HDAC1KDM4EALDH1A1JAK2JAK1 | |
| SCHEMBL22562998 | 0.76 | MAPK14 (0.33) | HDAC1HDAC3HDAC2NCOR2 | |
| SCHEMBL22562958 | 0.76 | JAK1 (0.37) | HDAC1KDM4EALDH1A1JAK2JAK1 | |
| SCHEMBL22563056 | 0.72 | HDAC1 (0.41) | HDAC1HDAC3HDAC2NCOR2KDM4E | |
| SCHEMBL22564671 | 0.69 | HDAC8 (0.34) | HDAC1HDAC3HDAC2NCOR2KDM4E | |
| SCHEMBL22563010 | 0.66 | HDAC6 (0.37) | HDAC1JAK1JAK3TYK2HDAC6 |
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-3725777-A1 | BENZO- AND PYRIDO-PYRAZOLES AS PROTEIN KINASE INHIBITORS | Rottapharm Biotech S.r.l. (IT) | 2020-10-21 | — | — | EP | disclosed |