Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | BRAF | P15056 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | PHGDH | O43175 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 5/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | GFER | P55789 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL1663114 | 0.82 | BRAF (0.31) | ALDH1A1BRAFSMN1; SMN2 | |
| SCHEMBL28296311 | 0.81 | PHGDH (0.40) | ALDH1A1POLBMAPK1SMN1; SMN2PHGDH | |
| SCHEMBL1662688 | 0.79 | GPR119 (0.48) | ALDH1A1SMN1; SMN2MAPTLMNAMEN1 | |
| SCHEMBL671924 | 0.77 | AOC3 (0.38) | ALDH1A1KDM4ETSHRPOLBMAPK1 | |
| SCHEMBL12631516 | 0.70 | ALDH1A1 (0.46) | ALDH1A1MAPK1SMN1; SMN2PHGDHMAPT | |
| SCHEMBL12631522 | 0.69 | SMN1; SMN2 (0.56) | ALDH1A1KDM4ETSHRPOLBMAPK1 | |
| SCHEMBL27250548 | 0.68 | ALDH1A1 (0.37) | ALDH1A1KDM4ETSHRSMN1; SMN2MAPT | |
| SCHEMBL16429868 | 0.68 | ALDH1A1 (0.46) | ALDH1A1KDM4ETSHRPOLBMAPK1 | |
| SCHEMBL11364687 | 0.68 | MAPT (0.60) | ALDH1A1KDM4EPOLBMAPK1SMN1; SMN2 | |
| SCHEMBL671726 | 0.68 | DRD2 (0.39) | ALDH1A1KDM4ETSHRPOLBMAPK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2491039-A1 | HETEROCYCLYL PYRAZOLOPYRIMIDINE ANALOGUES AS JAK INHIBITORS | Cellzome Limited (GB) | 2012-08-29 | — | — | EP | disclosed |
| WO-2011048082-A1 | HETEROCYCLYL PYRAZOLOPYRIMIDINE ANALOGUES AS JAK INHIBITORS | CELLZOME LIMITED (GB) | 2011-04-28 | — | — | WO | disclosed |