Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.42 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.42 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.42 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.42 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.42 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3175775 | 0.90 | ADORA3 (0.48) | ADORA3L3MBTL1MEN1NPC1RAB9A | |
| SCHEMBL3176983 | 0.89 | ADORA3 (0.57) | ADORA3L3MBTL1MEN1NPC1RAB9A | |
| SCHEMBL3163156 | 0.89 | RAB9A (0.48) | ADORA3L3MBTL1MEN1NPC1RAB9A | |
| SCHEMBL3164826 | 0.89 | CYP3A4 (0.49) | ADORA3RAB9AKDM4EMAPK1ALDH1A1 | |
| SCHEMBL3172697 | 0.88 | NPC1 (0.47) | ADORA3L3MBTL1MEN1NPC1RAB9A | |
| SCHEMBL3163063 | 0.87 | MAPT (0.55) | ADORA3MEN1NPC1RAB9AKMT2A | |
| SCHEMBL3170553 | 0.87 | TP53 (0.53) | ADORA3L3MBTL1MEN1NPC1RAB9A | |
| SCHEMBL3163297 | 0.87 | NPC1 (0.55) | ADORA3L3MBTL1MEN1NPC1RAB9A | |
| SCHEMBL3170716 | 0.86 | MAPT (0.53) | ADORA3L3MBTL1MEN1NPC1RAB9A | |
| SCHEMBL3156479 | 0.86 | ALDH1A1 (0.53) | ADORA3L3MBTL1MEN1NPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1465631-B1 | PYRIMIDINE A2B SELECTIVE ANTAGONIST COMPOUNDS, THEIR SYNTHESIS AND USE | OSI PHARM INC (US) | 2010-02-24 | — | — | EP | disclosed |