Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RY12 | Q9H244 | 8/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.45 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL3163144 | 0.91 | ADORA3 (0.46) | ALDH1A1LMNAMAPTKMT2ATSHR | |
| SCHEMBL3171920 | 0.90 | ADORA1 (0.47) | ALDH1A1ADORA3KDM4E | |
| SCHEMBL3176144 | 0.90 | ALDH1A1 (0.46) | P2RY12ALDH1A1MAPTADORA3 | |
| SCHEMBL3164709 | 0.87 | NPC1 (0.47) | ALDH1A1MAPTKMT2ANPSR1ADORA3 | |
| SCHEMBL3163125 | 0.87 | NPC1 (0.47) | ALDH1A1MAPTKMT2ANPSR1ADORA3 | |
| SCHEMBL3260230 | 0.86 | ADORA3 (0.46) | ALDH1A1KMT2AADORA3 | |
| SCHEMBL3163746 | 0.86 | ALDH1A1 (0.50) | ALDH1A1MAPTKMT2ANPSR1ADORA3 | |
| SCHEMBL3169937 | 0.86 | ALDH1A1 (0.48) | ALDH1A1ADORA3 | |
| SCHEMBL3162425 | 0.86 | EGFR (0.53) | ALDH1A1LMNAMAPTKMT2ATSHR | |
| SCHEMBL3165639 | 0.86 | ADORA3 (0.43) | ALDH1A1KMT2ATSHRADORA3KDM4E |
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 |