Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 14/20 | 0.44 |
| ▸ | MAOA | P21397 | 11/20 | 0.44 |
| ▸ | KDM1A | O60341 | 8/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL28653752 | 0.83 | OPRM1 (0.46) | TRPA1MAOBMAOAKDM1APTGS2 | |
| SCHEMBL7254284 | 0.72 | TRPA1 (0.53) | TRPA1MAOBMAOAKDM1ALMNA | |
| SCHEMBL6023457 | 0.71 | TRPA1 (0.43) | TRPA1MAOBMAOAKDM1ASLC18A3 | |
| SCHEMBL6023453 | 0.71 | TRPA1 (0.43) | TRPA1MAOBMAOAKDM1ASLC18A3 | |
| SCHEMBL20437086 | 0.71 | TRPA1 (0.47) | TRPA1SLC18A3SIGMAR1 | |
| SCHEMBL2857850 | 0.71 | OPRM1 (0.45) | MAOBMAOA | |
| SCHEMBL1085761 | 0.70 | MAOB (0.43) | TRPA1MAOBMAOAKDM1ASLC18A3 | |
| SCHEMBL7397920 | 0.70 | AKR1C3 (0.46) | TRPA1MAOBMAOAKDM1ASLC18A3 | |
| SCHEMBL28327738 | 0.69 | TRPA1 (0.42) | TRPA1MAOBMAOAKDM1ASLC18A3 | |
| Hydrogen Peroxide SCHEMBL2353767 | 0.68 | SLC18A3 (0.64) | SLC18A3SIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0540108-B1 | Catalyst composition | SHELL INT RESEARCH (NL) | 1996-01-03 | — | — | EP | disclosed |
| US-5279999-A | Catalyst composition | SHELL OIL COMPANY (US) | 1994-01-18 | — | — | US | disclosed |
| EP-0540108-A1 | Catalyst composition | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1993-05-05 | — | — | EP | disclosed |