Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | PROKR1 | Q8TCW9 | 3/20 | 0.33 |
| ▸ | FPR2 | P25090 | 2/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | PTGIR | P43119 | 1/20 | 0.32 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | RPS6KA1 | Q15418 | 1/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.32 |
| ▸ | DRD4 | P21917 | 1/20 | 0.32 |
| ▸ | PNMT | P11086 | 1/20 | 0.32 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 3/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8963053 | 1.00 | KCNH2 (0.33) | KCNH2PROKR1FPR2TRPA1PTGIR | |
| SCHEMBL8963287 | 0.96 | PROKR1 (0.33) | KCNH2PROKR1FPR2TRPA1PTGIR | |
| SCHEMBL8963292 | 0.96 | PROKR1 (0.33) | KCNH2PROKR1FPR2TRPA1PTGIR | |
| SCHEMBL9540834 | 0.93 | GRM2 (0.32) | KCNH2PROKR1FPR2 | |
| SCHEMBL9450833 | 0.90 | CNR1 (0.32) | — | |
| SCHEMBL8962798 | 0.89 | CNR1 (0.36) | MAOBMAOASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL8962799 | 0.89 | CNR1 (0.36) | MAOBMAOASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL8963255 | 0.85 | EP300 (0.32) | KCNH2MAOBMAOASLC6A2SLC6A4 | |
| SCHEMBL8963262 | 0.85 | EP300 (0.32) | KCNH2MAOBMAOASLC6A2SLC6A4 | |
| SCHEMBL9265771 | 0.85 | PROKR1 (0.35) | KCNH2PROKR1FPR2SLC6A2SLC6A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0559860-B1 | HALOVINYL-DERIVATIVES | HOFFMANN LA ROCHE (CH) | 1996-02-14 | — | — | EP | disclosed |
| US-5364556-A | Halovinyl-derivatives | HOFFMANN-LA ROCHE INC. (US) | 1994-11-15 | — | — | US | disclosed |