Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NT5E | P21589 | 1/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 9/20 | 0.40 |
| ▸ | HSP90AB1 | P08238 | 9/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | AHCY | P23526 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6473284 | 0.85 | ADORA2A (0.54) | NT5EADORA2AADORA3ADORA1CYP1A2 | |
| SCHEMBL23358348 | 0.80 | AHCY (0.48) | NT5EHSP90AA1HSP90AB1HDAC6HDAC4 | |
| SCHEMBL9311466 | 0.80 | AHCY (0.54) | NT5EHDAC6HDAC4HDAC1ADORA2A | |
| SCHEMBL9021704 | 0.79 | NT5E (0.43) | NT5EADORA2AADORA3ADORA1AHCY | |
| SCHEMBL9021496 | 0.79 | NT5E (0.43) | NT5EADORA2AADORA3ADORA1AHCY | |
| Sulfuric Acid SCHEMBL9424258 | 0.79 | CYP1A2 (0.55) | NT5EADORA2AADORA3ADORA1CYP1A2 | |
| Hydrochloric Acid SCHEMBL23358343 | 0.79 | AHCY (0.47) | NT5EHSP90AA1HSP90AB1HDAC6HDAC4 | |
| SCHEMBL9021513 | 0.79 | NT5E (0.43) | NT5EADORA2AADORA3ADORA1AHCY | |
| SCHEMBL9021493 | 0.79 | NT5E (0.43) | NT5EADORA2AADORA3ADORA1AHCY | |
| Hydrochloric Acid SCHEMBL7661516 | 0.78 | NT5E (0.42) | NT5EADORA2AADORA3ADORA1AHCY |
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-0741710-A1 | CHLOROPYRIMIDE INTERMEDIATES | THE WELLCOME FOUNDATION LIMITED (GB) | 1996-11-13 | — | — | EP | disclosed |