Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.41 |
| ▸ | HCAR2 | Q8TDS4 | 3/20 | 0.41 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.41 |
| ▸ | TTR | P02766 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | MGAM | O43451 | 1/20 | 0.37 |
| ▸ | GRM5 | P41594 | 2/20 | 0.36 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.36 |
| ▸ | TPMT | P51580 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL476528 | 0.81 | ALDH1A1 (0.47) | ALDH1A1KDM4EHCAR3HCAR2NAPRT | |
| SCHEMBL31132753 | 0.81 | ALDH1A1 (0.47) | ALDH1A1KDM4EHCAR3HCAR2NAPRT | |
| SCHEMBL9648858 | 0.80 | ALDH1A1 (0.43) | ALDH1A1KDM4EHCAR3HCAR2NAPRT | |
| SCHEMBL476556 | 0.77 | MAPT (0.48) | ALDH1A1KDM4EHCAR3GAAPOLB | |
| SCHEMBL25933680 | 0.76 | HCAR3 (0.54) | ALDH1A1HCAR3POLB | |
| SCHEMBL2421299 | 0.74 | ALDH1A1 (0.41) | ALDH1A1HCAR3HCAR2NAPRTTTR | |
| SCHEMBL3635781 | 0.74 | HCAR3 (0.54) | HCAR3MGAMGRM5SMN1; SMN2MEN1 | |
| SCHEMBL3635976 | 0.74 | GRM5 (0.51) | KDM4EGAATDP1POLBHSD17B10 | |
| SCHEMBL990334 | 0.73 | GRM5 (0.58) | TDP1POLBGRM5SMN1; SMN2MEN1 | |
| SCHEMBL1105964 | 0.73 | HCAR2 (0.47) | ALDH1A1KDM4EHCAR3HCAR2NAPRT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1458684-A2 | THERAPEUTIC HETEROCYCLES | AstraZeneca AB (SE) | 2004-09-22 | — | — | EP | disclosed |
| WO-2003051276-A2 | THERAPEUTIC HETEROCYCLES | ASTRAZENECA AB (SE) | 2003-06-26 | — | — | WO | disclosed |