Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHCY | P23526 | 10/20 | 0.67 |
| ▸ | ADORA2A | P29274 | 6/20 | 0.67 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | PI4KA | P42356 | 1/20 | 0.50 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.50 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.50 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.50 |
| ▸ | ADCY5 | O95622 | 1/20 | 0.49 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL11611616 | 0.82 | ADORA2A (0.51) | AHCYADORA2AADORA1ALDH1A1ADCY5 | |
| SCHEMBL16603993 | 0.82 | AHCY (0.85) | AHCYADORA2AADORA1ALDH1A1PI4KA | |
| SCHEMBL6029039 | 0.81 | ADORA2A (0.69) | AHCYADORA2AADORA1PI4KAPI4K2B | |
| SCHEMBL13394191 | 0.81 | AHCY (0.79) | AHCYADORA2AADORA1ALDH1A1PI4KA | |
| (S)-Dhpa SCHEMBL936286 | 0.81 | AHCY (1.00) | AHCYADORA2AADORA1ALDH1A1PI4KA | |
| (S)-Dhpa SCHEMBL936287 | 0.81 | AHCY (1.00) | AHCYADORA2AADORA1ALDH1A1PI4KA | |
| (S)-Dhpa SCHEMBL28605202 | 0.81 | AHCY (1.00) | AHCYADORA2AADORA1ALDH1A1PI4KA | |
| SCHEMBL13394189 | 0.79 | ADORA2A (0.76) | AHCYADORA2AADORA1ALDH1A1PI4KA | |
| SCHEMBL14963614 | 0.79 | ADORA2A (0.76) | AHCYADORA2AADORA1ALDH1A1PI4KA | |
| SCHEMBL28068456 | 0.78 | AHCY (0.78) | AHCYADORA2AADORA1ALDH1A1PI4KA |
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 |
|---|---|---|---|---|---|---|---|
| US-4123534-A | VIGILANCE INCREASING AGENTS | Wulfing, Johann W. (DE) | 1978-10-31 | — | — | US | claimed |
| US-4123534-A | VIGILANCE INCREASING AGENTS | Wulfing, Johann W. (DE) | 1978-10-31 | — | — | US | disclosed |