Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 6/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 6/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 6/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.40 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.38 |
| ▸ | JAK2 | O60674 | 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 | |
|---|---|---|---|---|
| SCHEMBL8068379 | 0.88 | PDK1 (0.46) | CHRM2CHRM1CHRM3NPC1ALDH1A1 | |
| SCHEMBL7107756 | 0.77 | TRPM8 (0.59) | CHRM2CHRM1CHRM3NPC1ALDH1A1 | |
| SCHEMBL11552690 | 0.75 | NPC1 (0.50) | CHRM2CHRM1CHRM3NPC1ALDH1A1 | |
| SCHEMBL7109134 | 0.71 | KDM4E (0.44) | NPC1ALDH1A1RAB9ATRPM8 | |
| SCHEMBL1925076 | 0.70 | ALDH1A1 (0.59) | CHRM2CHRM1CHRM3NPC1ALDH1A1 | |
| SCHEMBL7105650 | 0.67 | TDP1 (0.44) | CHRM2CHRM1CHRM3ALDH1A1 | |
| SCHEMBL28207526 | 0.67 | CHRM2 (0.52) | CHRM2CHRM1CHRM3NPC1ALDH1A1 | |
| SCHEMBL6003098 | 0.67 | NPC1 (0.57) | CHRM2CHRM1CHRM3NPC1ALDH1A1 | |
| SCHEMBL6003103 | 0.67 | NPC1 (0.57) | CHRM2CHRM1CHRM3NPC1ALDH1A1 | |
| SCHEMBL14775503 | 0.67 | MAOB (0.58) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1013639-A1 | Aryl carboxylic acid and tetrazole derivatives comprising a carbamoyloxy unit | F. HOFFMANN-LA ROCHE AG (CH) | 2000-06-28 | — | — | EP | disclosed |