Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | TP53BP1 | Q12888 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | DDR1 | Q08345 | 1/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.44 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | RHOC | P08134 | 1/20 | 0.44 |
| ▸ | RHOA | P61586 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | ABL1 | P00519 | 1/20 | 0.43 |
| ▸ | BCR | P11274 | 1/20 | 0.43 |
| ▸ | PPARG | P37231 | 2/20 | 0.43 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3172317 | 0.92 | ADORA2A (0.53) | ALDH1A1POLBTP53BP1MAPTRXFP1 | |
| SCHEMBL3172187 | 0.88 | ALDH1A1 (0.54) | ALDH1A1MAPTADORA2AADORA1TP53 | |
| SCHEMBL3170464 | 0.86 | L3MBTL1 (0.48) | ALDH1A1TP53BP1MAPTADORA2AADORA1 | |
| SCHEMBL3156001 | 0.85 | ADORA2A (0.56) | ALDH1A1POLBMAPTADORA2AADORA1 | |
| SCHEMBL3167813 | 0.83 | ADORA2A (0.56) | ALDH1A1MAPTADORA2AADORA1TP53 | |
| SCHEMBL3163059 | 0.83 | ALDH1A1 (0.46) | ALDH1A1MAPTADORA2AADORA1TP53 | |
| SCHEMBL3156347 | 0.82 | TP53 (0.52) | ALDH1A1POLBMAPTADORA2AADORA1 | |
| SCHEMBL3175707 | 0.82 | ALDH1A1 (0.53) | ALDH1A1POLBMAPTADORA2AADORA1 | |
| SCHEMBL3258726 | 0.81 | ADORA2A (0.57) | ALDH1A1POLBMAPTRXFP1ADORA2A | |
| SCHEMBL3163026 | 0.81 | MEN1 (0.50) | ALDH1A1POLBMAPTADORA2AADORA1 |
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 |