Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 5/20 | 0.46 |
| ▸ | RAB9A | P51151 | 7/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | RAD52 | P43351 | 1/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9329454 | 0.92 | PDE5A (0.49) | CYP2C19CYP1A2ALDH1A1GAALMNA | |
| SCHEMBL9329949 | 0.87 | L3MBTL1 (0.50) | CYP2C19CYP1A2ALDH1A1GAARAB9A | |
| SCHEMBL9329414 | 0.86 | CYP2C19 (0.43) | CYP2C19CYP1A2ALDH1A1GAARAB9A | |
| SCHEMBL9331832 | 0.85 | CYP2C19 (0.42) | CYP2C19CYP1A2ALDH1A1GAARAB9A | |
| SCHEMBL9329282 | 0.85 | CYP2C19 (0.45) | CYP2C19CYP1A2ALDH1A1GAARAB9A | |
| SCHEMBL9329984 | 0.81 | RAB9A (0.55) | CYP2C19CYP1A2ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL9328726 | 0.80 | HIF1A (0.54) | CYP2C19ALDH1A1RAB9ASMN1; SMN2NPC1 | |
| Hydrochloric Acid SCHEMBL9329264 | 0.79 | HIF1A (0.53) | CYP2C19ALDH1A1RAB9ASMN1; SMN2NPC1 | |
| SCHEMBL9329461 | 0.78 | MEN1 (0.48) | CYP2C19CYP1A2ALDH1A1GAARAB9A | |
| Hydrochloric Acid SCHEMBL9331249 | 0.78 | CYP2C9 (0.41) | CYP2C19CYP1A2GAARAB9ASMN1; SMN2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0300400-B1 | Nitric acid ester derivative | FUJISAWA PHARMACEUTICAL CO (JP) | 1994-03-16 | — | — | EP | disclosed |
| US-5010093-A | Vasodilators; cardiovascular disorders | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1991-04-23 | — | — | US | disclosed |
| US-4923886-A | VASODILATORS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1990-05-08 | — | — | US | disclosed |
| EP-0300400-A1 | Nitric acid ester derivative | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1989-01-25 | — | — | EP | disclosed |