Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA3 | P32297 | 4/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 4/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 3/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.39 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | LOX | P28300 | 1/20 | 0.36 |
| ▸ | LOXL3 | P58215 | 1/20 | 0.36 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.36 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL18970901 | 0.92 | CHRM4 (0.38) | CHRNA3CHRNB2CHRNB4CHRNA4CHRM4 | |
| SCHEMBL20609194 | 0.92 | CHRM4 (0.38) | CHRNA3CHRNB2CHRNB4CHRNA4CHRM4 | |
| SCHEMBL20609193 | 0.92 | CHRM4 (0.38) | CHRNA3CHRNB2CHRNB4CHRNA4CHRM4 | |
| SCHEMBL18952559 | 0.92 | CHRM4 (0.38) | CHRNA3CHRNB2CHRNB4CHRNA4CHRM4 | |
| SCHEMBL20031740 | 0.92 | CHRM4 (0.38) | CHRNA3CHRNB2CHRNB4CHRNA4CHRM4 | |
| SCHEMBL18971107 | 0.86 | CHRNB4 (0.38) | CHRNA3CHRNB2CHRNB4CHRNA4CHRM4 | |
| SCHEMBL20159647 | 0.78 | CHRNB2 (0.40) | CHRNA3CHRNB2CHRNB4CHRNA4CHRM1 | |
| SCHEMBL31614752 | 0.78 | CHRM4 (0.41) | CHRNA3CHRNB4CHRM4CHRM1LOX | |
| SCHEMBL23504818 | 0.77 | CHRNA3 (0.36) | CHRNA3CHRNB2CHRNB4CHRNA4CHRNA7 | |
| SCHEMBL19787604 | 0.77 | CHRM4 (0.43) | CHRM4CHRM1LOXLOXL2CYP17A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018087018-A1 | PHENOXYTRIAZOLES | F. HOFFMANN-LA ROCHE AG (CH) | 2018-05-17 | — | — | WO | disclosed |