Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | CCR4 | P51679 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | PTK2B | Q14289 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | HRH4 | Q9H3N8 | 4/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.33 |
| ▸ | SIRT6 | Q8N6T7 | 2/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.33 |
| ▸ | HTR3A | P46098 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 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 | |
|---|---|---|---|---|
| SCHEMBL29925545 | 0.86 | KDM4E (0.39) | MAOBKDM4EMAPTMAPK1HTT | |
| SCHEMBL27032333 | 0.86 | KDM4E (0.39) | MAOBKDM4EMAPTMAPK1HTT | |
| SCHEMBL16795178 | 0.82 | ALDH1A1 (0.37) | MAOBGAAMAPTALDH1A1DRD2 | |
| SCHEMBL31298214 | 0.78 | ADRA2C (0.51) | KDM4EGAAMAPTPTK2BMAPK1 | |
| SCHEMBL2940900 | 0.78 | ADRA2C (0.51) | KDM4EGAAMAPTPTK2BMAPK1 | |
| SCHEMBL19583 | 0.77 | ALDH1A1 (0.49) | KDM4EGAAMAPTPTK2BMAPK1 | |
| SCHEMBL3803696 | 0.77 | NOS3 (0.38) | KDM4EGAAMAPTPTK2BMAPK1 | |
| SCHEMBL16426120 | 0.76 | LPL (0.44) | — | |
| SCHEMBL28628663 | 0.76 | LPL (0.44) | — | |
| SCHEMBL30934957 | 0.76 | JAK3 (0.41) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015086693-A1 | PYRAZOLOPYRIMIDIN-2-YL DERIVATIVES AS JAK INHIBITORS | ALMIRALL, S.A. (ES) | 2015-06-18 | — | — | WO | disclosed |