Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.46 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.43 |
| ▸ | RECQL | P46063 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | HBB | P68871 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | TP53BP1 | Q12888 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL3177178 | 0.91 | ADORA2A (0.56) | L3MBTL1ADORA2AADORA1ALDH1A1LMNA | |
| SCHEMBL3172187 | 0.90 | ALDH1A1 (0.54) | ADORA2AADORA1ALDH1A1LMNATP53 | |
| SCHEMBL3170831 | 0.88 | L3MBTL1 (0.50) | L3MBTL1ALDH1A1LMNATP53MAPT | |
| SCHEMBL3156001 | 0.88 | ADORA2A (0.56) | L3MBTL1ADORA2AADORA1ALDH1A1LMNA | |
| SCHEMBL3161520 | 0.86 | ALDH1A1 (0.45) | L3MBTL1ADORA2AADORA1ALDH1A1LMNA | |
| SCHEMBL3172362 | 0.86 | ALDH1A1 (0.50) | ADORA2AADORA1ALDH1A1TP53MAPT | |
| SCHEMBL3167813 | 0.85 | ADORA2A (0.56) | L3MBTL1ADORA2AADORA1ALDH1A1LMNA | |
| SCHEMBL3175707 | 0.84 | ALDH1A1 (0.53) | L3MBTL1ADORA2AADORA1ALDH1A1LMNA | |
| SCHEMBL3163026 | 0.83 | MEN1 (0.50) | L3MBTL1ADORA2AADORA1ALDH1A1LMNA | |
| SCHEMBL3162448 | 0.83 | ALDH1A1 (0.46) | L3MBTL1ADORA2AADORA1ALDH1A1LMNA |
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 |