Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | NAAA | Q02083 | 2/20 | 0.47 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.47 |
| ▸ | MLYCD | O95822 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.45 |
| ▸ | TP53BP1 | Q12888 | 1/20 | 0.44 |
| ▸ | ERN1 | O75460 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | NAMPT | P43490 | 2/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.42 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5046329 | 1.00 | ALDH1A1 (0.48) | ALDH1A1POLBNAAAMRGPRX4MLYCD | |
| SCHEMBL5047208 | 0.88 | AKR1C3 (0.47) | ALDH1A1POLBHDAC1EPHX2AKR1C3 | |
| SCHEMBL5044168 | 0.83 | ALDH1A1 (0.47) | ALDH1A1POLBNAAAMRGPRX4MLYCD | |
| SCHEMBL5045562 | 0.83 | ALDH1A1 (0.47) | ALDH1A1POLBNAAAMRGPRX4MLYCD | |
| SCHEMBL1861375 | 0.81 | NAAA (0.48) | ALDH1A1POLBNAAAMRGPRX4MLYCD | |
| SCHEMBL1857017 | 0.81 | NAAA (0.48) | ALDH1A1POLBNAAAMRGPRX4MLYCD | |
| SCHEMBL5046272 | 0.81 | NAAA (0.57) | NAAAMLYCDSMN1; SMN2HDAC1HDAC2 | |
| SCHEMBL5039647 | 0.80 | TACR1 (0.54) | HDAC2EPHX2BCL2L1MCL1AKR1C3 | |
| SCHEMBL5047162 | 0.78 | HDAC1 (0.44) | ALDH1A1POLBNAAAMRGPRX4MLYCD | |
| SCHEMBL5039660 | 0.78 | HDAC1 (0.44) | ALDH1A1POLBNAAAMRGPRX4MLYCD |
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-1732534-B1 | USE OF METHYLENE AMIDE DERIVATIVES IN CARDIOVASCULAR DISORDERS | SERONO LAB (CH) | 2008-07-23 | — | — | EP | claimed |