Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.32 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.31 |
| ▸ | CUL4A | Q13619 | 1/20 | 0.31 |
| ▸ | SQOR | Q9Y6N5 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2660260 | 0.82 | ALDH1A1 (0.37) | ALDH1A1KDM4EHPGDGLAGAA | |
| SCHEMBL2659502 | 0.80 | CYP11B1 (0.33) | ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL2649862 | 0.77 | KDM4E (0.38) | ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL2649665 | 0.74 | GABRA1 (0.35) | ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL1829521 | 0.72 | KDM4E (0.31) | ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL2657263 | 0.71 | ABL1 (0.32) | — | |
| SCHEMBL5892492 | 0.71 | ALDH1A1 (0.33) | ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL29777949 | 0.71 | ALDH1A1 (0.33) | ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL16136495 | 0.70 | ALDH1A1 (0.33) | ALDH1A1 | |
| SCHEMBL2661559 | 0.70 | ACLY (0.38) | ALDH1A1KDM4EHPGDGAAADORA1 |
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 |