Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 8/20 | 0.88 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.77 |
| ▸ | ADCY1 | Q08828 | 1/20 | 0.76 |
| ▸ | ADCY5 | O95622 | 4/20 | 0.66 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.63 |
| ▸ | PI4KA | P42356 | 1/20 | 0.58 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.58 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.58 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.58 |
| ▸ | AHCY | P23526 | 5/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL19553487 | 0.98 | ADORA2A (0.91) | ADORA2AADORA1ADCY1ADCY5ADORA2B | |
| SCHEMBL1635576 | 0.94 | ADORA2A (1.00) | ADORA2AADORA1ADCY1ADCY5ADORA2B | |
| SCHEMBL29459142 | 0.87 | ADORA2A (1.00) | ADORA2AADORA1ADCY1ADCY5ADORA2B | |
| SCHEMBL984944 | 0.87 | ADORA2A (1.00) | ADORA2AADORA1ADCY1ADCY5ADORA2B | |
| Nb-001 SCHEMBL29886392 | 0.86 | ADCY1 (1.00) | ADORA2AADORA1ADCY1ADCY5ADORA2B | |
| Nb-001 SCHEMBL13697544 | 0.86 | ADCY1 (1.00) | ADORA2AADORA1ADCY1ADCY5ADORA2B | |
| SCHEMBL38913 | 0.86 | ADORA2A (0.70) | ADORA2AADORA1ADCY1ADCY5ADORA2B | |
| Hydrochloric Acid SCHEMBL9193028 | 0.86 | ADORA2A (0.97) | ADORA2AADORA1ADCY1ADCY5ADORA2B | |
| SCHEMBL23228230 | 0.85 | ADORA2A (0.88) | ADORA2AADORA1ADCY1ADCY5ADORA2B | |
| SCHEMBL16057701 | 0.85 | ADORA2A (0.68) | ADORA2AADORA1ADCY1ADCY5ADORA2B |
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 |
|---|---|---|---|---|---|---|---|
| US-5994361-A | ANTITUMOR, ANTICANCER AGENT | BIOCHEM PHARMA (CA) | 1999-11-30 | — | — | US | claimed |