Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GPR6 | P46095 | 3/20 | 0.37 |
| ▸ | OGA | O60502 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2932222 | 0.90 | KDM4E (0.38) | ALDH1A1GPR6OGAADORA2AADORA1 | |
| SCHEMBL1761031 | 0.89 | HSD17B10 (0.43) | ACHEBCHEHSD17B10ALDH1A1GPR6 | |
| SCHEMBL3050426 | 0.86 | BCHE (0.42) | ACHEBCHEGPR6OGAADORA2A | |
| SCHEMBL2934358 | 0.84 | ACHE (0.41) | ACHEBCHEALDH1A1MAPT | |
| SCHEMBL2930557 | 0.82 | HTT (0.38) | ALDH1A1MAPTNPSR1ADORA2AADORA1 | |
| SCHEMBL2929411 | 0.82 | ADORA2A (0.41) | ACHEALDH1A1OGAMAPTADORA2A | |
| SCHEMBL2931169 | 0.82 | OGA (0.38) | ACHEGPR6OGAADORA2AADORA1 | |
| SCHEMBL2930809 | 0.81 | LMNA (0.40) | ACHEALDH1A1MAPTADORA2AADORA1 | |
| SCHEMBL2930506 | 0.81 | GPR6 (0.38) | ACHEALDH1A1GPR6 | |
| SCHEMBL2932276 | 0.81 | CYP2D6 (0.41) | ALDH1A1ADORA2AADORA1 |
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-2027132-B1 | THIAZOLO-PYRAMIDINE / PYRIDINE UREA DERIVATIVES AS ADENOSINE A2B RECEPTOR ANTAGONISTS | HOFFMANN LA ROCHE (CH) | 2010-09-15 | — | — | EP | claimed |