Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 5/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.39 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.38 |
| ▸ | CUL4A | Q13619 | 1/20 | 0.36 |
| ▸ | CHUK | O15111 | 1/20 | 0.36 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.36 |
| ▸ | EEF2K | O00418 | 1/20 | 0.35 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.34 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.34 |
| ▸ | MPL | P40238 | 1/20 | 0.34 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6695094 | 0.79 | ADORA1 (0.40) | ADORA1ADORA2AALDH1A1KDM4EGAA | |
| SCHEMBL21199975 | 0.77 | MPL (0.44) | ADORA1ADORA2AALDH1A1KDM4EDYRK1A | |
| SCHEMBL2569036 | 0.77 | ADORA1 (0.46) | ADORA1ADORA2AALDH1A1KDM4EGAA | |
| SCHEMBL29906554 | 0.75 | TRPV4 (0.37) | ADORA1ADORA2AALDH1A1KDM4EGAA | |
| SCHEMBL2597730 | 0.75 | TRPV4 (0.37) | ADORA1ADORA2AALDH1A1KDM4EGAA | |
| SCHEMBL2651221 | 0.75 | CYP11B1 (0.41) | ADORA1ADORA2AALDH1A1KDM4EGAA | |
| SCHEMBL2651898 | 0.74 | ADORA1 (0.41) | ADORA1ADORA2AALDH1A1KDM4EGAA | |
| SCHEMBL27886232 | 0.73 | ALDH1A1 (0.53) | ADORA1ADORA2AALDH1A1KDM4EGAA | |
| SCHEMBL2652485 | 0.72 | ALDH1A1 (0.49) | ADORA1ADORA2AALDH1A1KDM4EGAA | |
| SCHEMBL28456456 | 0.72 | MPL (0.43) | ADORA1ADORA2AALDH1A1KDM4EDYRK1A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002074772-A1 | IMIDAZO-PYRIMIDINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS | MERCK SHARP & DOHME LIMITED (GB) | 2002-09-26 | — | — | WO | disclosed |