Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 5/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | VCP | P55072 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | AHR | P35869 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ABL1 | P00519 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2713671 | 0.86 | ADORA1 (0.51) | ADORA1ADORA2AADORA3ALDH1A1KDM4E | |
| SCHEMBL30450912 | 0.82 | ADORA1 (0.47) | ADORA1ADORA2AADORA3ALDH1A1KDM4E | |
| SCHEMBL2713731 | 0.81 | HSD17B10 (0.49) | ADORA1ADORA2AADORA3ALDH1A1KDM4E | |
| SCHEMBL22809648 | 0.81 | ADORA1 (0.53) | ADORA1ADORA2AADORA3ALDH1A1KDM4E | |
| SCHEMBL4550418 | 0.77 | ADORA1 (0.45) | ADORA1ADORA2AADORA3KDM4EHPGD | |
| SCHEMBL18266404 | 0.73 | ADORA1 (0.47) | ADORA1ADORA2AADORA3ALDH1A1KDM4E | |
| SCHEMBL18266209 | 0.72 | MAPT (0.39) | ADORA1ADORA2AADORA3KDM4ENPSR1 | |
| SCHEMBL15358619 | 0.71 | ADORA1 (0.45) | ADORA1ADORA2AADORA3ALDH1A1KDM4E | |
| SCHEMBL18266606 | 0.71 | MAPT (0.38) | ADORA1ADORA2AADORA3KDM4ENPSR1 | |
| Hydrochloric Acid SCHEMBL15350578 | 0.70 | ADORA1 (0.44) | ADORA1ADORA2AADORA3ALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012053186-A1 | ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS | RAQUALIA PHARMA INC. (JP) | 2012-04-26 | — | — | WO | disclosed |