Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP2K2 | P36507 | 1/20 | 0.39 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.39 |
| ▸ | DHODH | Q02127 | 9/20 | 0.36 |
| ▸ | GAA | P10253 | 4/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | GFER | P55789 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.33 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.33 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.33 |
| ▸ | CSF1R | P07333 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 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 | |
|---|---|---|---|---|
| SCHEMBL22562967 | 0.86 | NUDT1 (0.37) | MAP2K1GAAKDM4EMAPTGFER | |
| SCHEMBL22563002 | 0.86 | MAP2K2 (0.41) | MAP2K2MAP2K1DHODHGAAKDM4E | |
| SCHEMBL22563054 | 0.85 | MAPK14 (0.40) | GAAKDM4EMAPTSMN1; SMN2HSD17B10 | |
| SCHEMBL22562957 | 0.83 | MAP2K1 (0.41) | MAP2K1GAAKDM4EMEN1KMT2A | |
| SCHEMBL22563085 | 0.79 | PYGL (0.41) | GAATDP1MAPK13MAPK12MAPK11 | |
| SCHEMBL22563010 | 0.77 | HDAC6 (0.37) | MAPK13MAPK12MAPK11MAPK14HDAC1 | |
| SCHEMBL22563088 | 0.74 | MAPK14 (0.44) | GAAMAPTKMT2ATDP1MAPK13 | |
| SCHEMBL22562974 | 0.74 | TAS2R14 (0.42) | GAAKDM4EMAPTGFERSMN1; SMN2 | |
| SCHEMBL18590739 | 0.72 | SOS1 (0.46) | MAP2K2MAP2K1DHODHGAAKDM4E | |
| SCHEMBL22563163 | 0.72 | HDAC1 (0.40) | MAP2K1GAAKDM4EMAPTGFER |
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 |