Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.34 |
| ▸ | RAB9A | P51151 | 3/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | DRD1 | P21728 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2879790 | 0.89 | NPC1 (0.39) | TRPA1CYP1A2CYP2A6NPC1RAB9A | |
| SCHEMBL9158186 | 0.79 | SLC6A2 (0.43) | DRD2HTR2AHTR2CALDH1A1LMNA | |
| SCHEMBL5713934 | 0.74 | CNR1 (0.38) | NPC1RAB9ADRD2HTR2CHTR2B | |
| SCHEMBL3593836 | 0.74 | LMNA (0.50) | NPC1RAB9AMAPTALDH1A1LMNA | |
| SCHEMBL2281882 | 0.72 | PARP10 (0.36) | TRPA1CYP1A2CYP2A6PARP1ALDH1A1 | |
| SCHEMBL5714220 | 0.72 | SKP2 (0.40) | CYP1A2NPC1RAB9ADRD2HTR2A | |
| SCHEMBL12961199 | 0.72 | TRPA1 (0.34) | TRPA1CYP1A2CYP2A6NPC1RAB9A | |
| SCHEMBL1492678 | 0.72 | PARP1 (0.41) | TRPA1CYP1A2CYP2A6NPC1RAB9A | |
| SCHEMBL7472705 | 0.72 | NQO1 (0.45) | CYP1A2NPC1RAB9APDK2MAPT | |
| SCHEMBL17666102 | 0.72 | NPC1 (0.46) | TRPA1CYP1A2CYP2A6NPC1RAB9A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5459142-A | Autoimmune disease, atherosclerosis, antiischemic agents and nephritis | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1995-10-17 | — | — | US | disclosed |
| EP-0511879-B1 | Pyrazine derivatives | OTSUKA PHARMA CO LTD (JP) | 1995-03-22 | — | — | EP | disclosed |
| EP-0511879-A1 | Pyrazine derivatives | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1992-11-04 | — | — | EP | disclosed |