Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | JAK3 | P52333 | 2/20 | 0.39 |
| ▸ | JAK2 | O60674 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 2/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.38 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.38 |
| ▸ | WNT3A | P56704 | 1/20 | 0.38 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.38 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3162425 | 0.87 | EGFR (0.53) | EGFRALDH1A1JAK3JAK2GFER | |
| SCHEMBL3166360 | 0.87 | HCAR2 (0.42) | ALDH1A1ADORA3ADORA2AADORA1ADORA2B | |
| SCHEMBL3162806 | 0.86 | JAK3 (0.51) | EGFRALDH1A1JAK3TSHRCYP1A2 | |
| SCHEMBL3164831 | 0.86 | MAPT (0.50) | EGFRALDH1A1JAK3JAK2KDR | |
| SCHEMBL3160939 | 0.85 | ALDH1A1 (0.52) | EGFRALDH1A1ADORA2AADORA1TSHR | |
| SCHEMBL3163746 | 0.85 | ALDH1A1 (0.50) | ALDH1A1ADORA3ADORA2AADORA1ADORA2B | |
| SCHEMBL3171920 | 0.85 | ADORA1 (0.47) | EGFRALDH1A1ADORA3ADORA2AADORA1 | |
| SCHEMBL3162693 | 0.85 | KMT2A (0.43) | EGFRALDH1A1ADORA3 | |
| SCHEMBL3172939 | 0.84 | DRD2 (0.44) | ALDH1A1ADORA2AADORA1TSHRCYP1A2 | |
| SCHEMBL3163144 | 0.84 | ADORA3 (0.46) | EGFRALDH1A1ADORA3ADORA2AADORA1 |
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 |