Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS2R14 | Q9NYV8 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | GAA | P10253 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.39 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 5/20 | 0.38 |
| ▸ | MAPK13 | O15264 | 3/20 | 0.38 |
| ▸ | MAPK12 | P53778 | 3/20 | 0.38 |
| ▸ | MAPK11 | Q15759 | 3/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | AURKA | O14965 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL22563054 | 0.84 | MAPK14 (0.40) | ALDH1A1GAAMAPTRAB9ASMN1; SMN2 | |
| SCHEMBL22563088 | 0.81 | MAPK14 (0.44) | ALDH1A1GAAMAPTMAPK14MAPK13 | |
| SCHEMBL22562946 | 0.74 | MAP2K2 (0.39) | ALDH1A1GAAMAPTSMN1; SMN2MAPK14 | |
| SCHEMBL22563085 | 0.73 | PYGL (0.41) | ALDH1A1GAAMAPK14MAPK13MAPK12 | |
| SCHEMBL22562967 | 0.73 | NUDT1 (0.37) | GAAMAPTRAB9ASMN1; SMN2POLB | |
| SCHEMBL22562958 | 0.71 | JAK1 (0.37) | ALDH1A1SIRT2MEN1KMT2AKDM4E | |
| SCHEMBL22563010 | 0.71 | HDAC6 (0.37) | MAPK14MAPK13MAPK12MAPK11 | |
| SCHEMBL22562957 | 0.71 | MAP2K1 (0.41) | ALDH1A1GAAL3MBTL1MEN1KMT2A | |
| SCHEMBL1921413 | 0.70 | ALDH1A1 (0.57) | TAS2R14ALDH1A1GAAMAPTRAB9A | |
| SCHEMBL22563179 | 0.69 | HDAC1 (0.44) | ALDH1A1GAAMAPTRAB9ASMN1; SMN2 |
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 |