Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 8/20 | 0.40 |
| ▸ | MAPK13 | O15264 | 4/20 | 0.40 |
| ▸ | MAPK12 | P53778 | 4/20 | 0.40 |
| ▸ | MAPK11 | Q15759 | 4/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.34 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.34 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | P2RY4 | P51582 | 1/20 | 0.33 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | SNCA | P37840 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22563179 | 0.85 | HDAC1 (0.44) | MAPK14MAPK13MAPK12MAPK11HDAC1 | |
| SCHEMBL22562946 | 0.85 | MAP2K2 (0.39) | MAPK14MAPK13MAPK12MAPK11HDAC1 | |
| SCHEMBL22563088 | 0.84 | MAPK14 (0.44) | MAPK14MAPK13MAPK12MAPK11MAPT | |
| SCHEMBL22562967 | 0.84 | NUDT1 (0.37) | HDAC1MAPTGAASMN1; SMN2KDM4E | |
| SCHEMBL22562974 | 0.84 | TAS2R14 (0.42) | MAPK14MAPK13MAPK12MAPK11MAPT | |
| SCHEMBL22563010 | 0.81 | HDAC6 (0.37) | MAPK14MAPK13MAPK12MAPK11HDAC1 | |
| SCHEMBL22562957 | 0.81 | MAP2K1 (0.41) | GAAKDM4EALDH1A1 | |
| SCHEMBL22562958 | 0.79 | JAK1 (0.37) | HDAC1SIRT2KDM4EALDH1A1 | |
| SCHEMBL22563085 | 0.79 | PYGL (0.41) | MAPK14MAPK13MAPK12MAPK11HDAC1 | |
| SCHEMBL24934060 | 0.72 | KEAP1 (0.39) | HDAC1GAAALDH1A1HTT |
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 |