Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 6/20 | 0.42 |
| ▸ | ADORA2B | P29275 | 4/20 | 0.42 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 6/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 6/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9325713 | 0.88 | ADORA3 (0.46) | ADORA3ADORA2BCSNK1DADORA1ADORA2A | |
| SCHEMBL9325911 | 0.82 | ADORA3 (0.62) | ADORA3ADORA2BLMNANPC1RAB9A | |
| SCHEMBL9329166 | 0.76 | ADORA3 (0.41) | ADORA3ADORA2BCSNK1DUSP2ALDH1A1 | |
| SCHEMBL23291366 | 0.70 | ADORA2A (0.38) | ADORA3ADORA2BCSNK1DADORA1ADORA2A | |
| SCHEMBL9328035 | 0.68 | ADORA3 (0.66) | ADORA3ADORA2BCSNK1DADORA1ADORA2A | |
| SCHEMBL7828518 | 0.68 | ADORA3 (0.73) | ADORA3ADORA2BADORA1ADORA2A | |
| SCHEMBL9327228 | 0.66 | ADORA2A (0.67) | ADORA3ADORA2BCSNK1DUSP2ALDH1A1 | |
| SCHEMBL23963281 | 0.65 | ADORA3 (0.56) | ADORA3ADORA2BCSNK1DALDH1A1LMNA | |
| SCHEMBL9325959 | 0.64 | ADORA3 (0.48) | ADORA3ADORA2BADORA1ADORA2A | |
| SCHEMBL9327033 | 0.64 | ADORA3 (0.51) | ADORA3ADORA2BADORA1ADORA2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5356894-A | Adenosine antagonists | SYNGENTA LIMITED (GB) | 1994-10-18 | — | — | US | disclosed |
| US-5270311-A | [1,2,4]-Triazolo[1,5-a]and pyrazolo[2,3-a][1,3,5]triazine derivatives | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-12-14 | — | — | US | disclosed |
| EP-0459702-A1 | Azole Derivatives | ZENECA LIMITED (GB) | 1991-12-04 | — | — | EP | disclosed |