Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.47 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.44 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | USP2 | O75604 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | F2R | P25116 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL13565155 | 1.00 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2NPSR1KCNK3KCNK9 | |
| SCHEMBL17090364 | 0.90 | LMNA (0.51) | SMN1; SMN2NPSR1LMNAMAPK14NPY5R | |
| SCHEMBL13565317 | 0.90 | LMNA (0.51) | SMN1; SMN2NPSR1LMNAMAPK14NPY5R | |
| SCHEMBL14424628 | 0.90 | ALDH1A1 (0.56) | ALDH1A1SMN1; SMN2NPSR1KCNK3KCNK9 | |
| SCHEMBL10114576 | 0.90 | ALDH1A1 (0.56) | ALDH1A1SMN1; SMN2NPSR1KCNK3KCNK9 | |
| SCHEMBL17090296 | 0.86 | POLB (0.41) | ALDH1A1SMN1; SMN2LMNAMAPK14NPY5R | |
| SCHEMBL13564937 | 0.86 | POLB (0.41) | ALDH1A1SMN1; SMN2LMNAMAPK14NPY5R | |
| SCHEMBL17090542 | 0.86 | LMNA (0.51) | ALDH1A1SMN1; SMN2NPSR1KCNK3KCNK9 | |
| SCHEMBL13565439 | 0.86 | LMNA (0.51) | ALDH1A1SMN1; SMN2NPSR1KCNK3KCNK9 | |
| SCHEMBL11942244 | 0.83 | ALDH1A1 (0.49) | ALDH1A1SMN1; SMN2NPSR1KCNK3KCNK9 |
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 |
|---|---|---|---|---|---|---|---|
| US-9139518-B2 | Amine derivative having NPY Y5 receptor antagonistic activity | SHIONOGI & CO., LTD. (JP) | 2015-09-22 | — | — | US | disclosed |