Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 1/20 | 0.47 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | AURKA | O14965 | 3/20 | 0.46 |
| ▸ | PIK3CB | P42338 | 4/20 | 0.43 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.43 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.43 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.43 |
| ▸ | MTOR | P42345 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL10679580 | 0.88 | ADORA2A (0.44) | ADORA2AADORA1GAAAURKARIPK1 | |
| SCHEMBL10681243 | 0.88 | ADORA2A (0.44) | ADORA2AADORA1GAAALDH1A1KDM4E | |
| SCHEMBL10678093 | 0.88 | AKT1 (0.47) | ADORA2AADORA1GAAALDH1A1KDM4E | |
| SCHEMBL10682561 | 0.87 | ADORA2A (0.46) | ADORA2AADORA1GAASMN1; SMN2AURKA | |
| SCHEMBL10678211 | 0.87 | ADORA2A (0.46) | ADORA2AADORA1GAASMN1; SMN2AURKA | |
| SCHEMBL10680533 | 0.86 | ADORA2A (0.43) | ADORA2AADORA1GAAALDH1A1KDM4E | |
| Water SCHEMBL10675127 | 0.85 | ADORA2A (0.46) | ADORA2AADORA1GAAALDH1A1KDM4E | |
| SCHEMBL10680987 | 0.81 | PIK3CB (0.50) | ALDH1A1KDM4EMEN1KMT2APIK3CB | |
| SCHEMBL10677336 | 0.77 | NPC1 (0.47) | ADORA2AADORA1GAAALDH1A1KDM4E | |
| SCHEMBL10674326 | 0.76 | NPC1 (0.46) | ADORA2AADORA1ALDH1A1KDM4EMEN1 |
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-4729995-A | ANTIALLERGENS | TOYO BOSEKI KABUSHIKI KAISHA (JP) | 1988-03-08 | — | — | US | disclosed |
| EP-0243817-A1 | Novel pyrimidine compounds | Toyo Boseki Kabushiki Kaisha (JP) | 1987-11-04 | — | — | EP | disclosed |