Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM4 | P08173 | 3/20 | 0.46 |
| ▸ | TRPV4 | Q9HBA0 | 2/20 | 0.46 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.42 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | REV1 | Q9UBZ9 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6858781 | 0.90 | CHRM4 (0.46) | CHRM4TRPV4ADORA2AADORA2BADORA1 | |
| SCHEMBL3046437 | 0.87 | ALDH1A1 (0.44) | ADORA2AADORA2BADORA1MAPTHSD17B10 | |
| SCHEMBL3048081 | 0.85 | CHRM4 (0.46) | CHRM4TRPV4ADORA2AADORA2BADORA1 | |
| SCHEMBL3051821 | 0.85 | ADORA2A (0.54) | ADORA2AADORA2BADORA1KMT2ANPC1 | |
| SCHEMBL3046444 | 0.80 | ALDH1A1 (0.49) | CHRM4ADORA2AADORA1MAPTHSD17B10 | |
| SCHEMBL3048474 | 0.80 | SMN1; SMN2 (0.46) | MAPTREV1ALDH1A1RAB9APOLB | |
| SCHEMBL3037818 | 0.80 | ALDH1A1 (0.51) | CHRM4ADORA2AADORA2BADORA1MAPT | |
| SCHEMBL3046735 | 0.79 | CHRM4 (0.48) | CHRM4ADORA2AADORA2BADORA1KMT2A | |
| SCHEMBL3039151 | 0.79 | ADORA2A (0.57) | ADORA2AADORA2BADORA1KMT2AMAPT | |
| SCHEMBL3048483 | 0.78 | ALDH1A1 (0.47) | MAPTHSD17B10REV1ALDH1A1RAB9A |
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-6835732-B2 | Modulation of the adenosine A2A receptor; cardioprotective agents; antiischemic agents; antihypoxia agents; central nervous system disorders, Alzheimer's disease, Parkinson's disease, anxiolytic agents; antidepressants; analgesics | HOFFMAN-LA ROCHE INC. | 2004-12-28 | — | — | US | claimed |