Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.55 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.55 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.55 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.55 |
| ▸ | PI4KA | P42356 | 2/20 | 0.37 |
| ▸ | PI4KB | Q9UBF8 | 2/20 | 0.37 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.37 |
| ▸ | PIP5K1C | O60331 | 1/20 | 0.37 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 7/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | NOS1 | P29475 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL6003356 | 0.83 | ADORA3 (0.58) | ADORA2AADORA1ADORA3ADORA2BALOX15 | |
| SCHEMBL11273216 | 0.79 | ADORA3 (0.48) | ADORA2AADORA1ADORA3ADORA2BPI4KA | |
| SCHEMBL3674565 | 0.78 | KDM4E (0.56) | ADORA2AADORA1ADORA3ADORA2BPI4KA | |
| SCHEMBL30585765 | 0.78 | KDM4E (0.56) | ADORA2AADORA1ADORA3ADORA2BPI4KA | |
| SCHEMBL20422809 | 0.75 | ADORA3 (0.49) | ADORA2AADORA1ADORA3ADORA2BRAB9A | |
| SCHEMBL18377816 | 0.74 | ADORA3 (0.47) | ADORA2AADORA1ADORA3ADORA2BRAB9A | |
| SCHEMBL16718760 | 0.74 | ADORA3 (0.47) | ADORA2AADORA1ADORA3ADORA2BPI4KA | |
| SCHEMBL6529431 | 0.73 | PSMD14 (0.30) | — | |
| SCHEMBL69810 | 0.71 | ADORA3 (1.00) | ADORA2AADORA1ADORA3ADORA2BALOX15 | |
| SCHEMBL10391988 | 0.71 | ADORA2A (0.49) | ADORA2AADORA1ADORA3ADORA2BHSP90AA1 |
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-0455356-A1 | Substituted 5-amino-1,2,4-thiadiazoles with pharmaceutical activity | LILLY INDUSTRIES LIMITED (GB) | 1991-11-06 | — | — | EP | disclosed |