Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM4 | P08173 | 1/20 | 0.38 |
| ▸ | CYP17A1 | P05093 | 4/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 4/20 | 0.35 |
| ▸ | CHRNA3 | P32297 | 3/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.35 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.35 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.35 |
| ▸ | LOX | P28300 | 1/20 | 0.35 |
| ▸ | LOXL3 | P58215 | 1/20 | 0.35 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.35 |
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 | 1.00 | CHRM4 (0.38) | CHRM4CYP17A1CHRNB2CHRNA3CHRNA4 | |
| SCHEMBL18952559 | 1.00 | CHRM4 (0.38) | CHRM4CYP17A1CHRNB2CHRNA3CHRNA4 | |
| SCHEMBL20609193 | 1.00 | CHRM4 (0.38) | CHRM4CYP17A1CHRNB2CHRNA3CHRNA4 | |
| SCHEMBL20609194 | 1.00 | CHRM4 (0.38) | CHRM4CYP17A1CHRNB2CHRNA3CHRNA4 | |
| SCHEMBL20159656 | 0.92 | CHRNA3 (0.39) | CHRM4CYP17A1CHRNB2CHRNA3CHRNA4 | |
| SCHEMBL18970981 | 0.79 | PSEN1 (0.46) | CHRM4CYP17A1LOXLOXL2 | |
| SCHEMBL21356458 | 0.79 | PSEN1 (0.46) | CHRM4CYP17A1LOXLOXL2 | |
| SCHEMBL18952617 | 0.79 | PSEN1 (0.46) | CHRM4CYP17A1LOXLOXL2 | |
| SCHEMBL21108536 | 0.79 | PSEN1 (0.46) | CHRM4CYP17A1LOXLOXL2 | |
| SCHEMBL18952615 | 0.79 | PSEN1 (0.46) | CHRM4CYP17A1LOXLOXL2 |
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-2018060300-A1 | BRIDGED PIPERIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2018-04-05 | — | — | WO | disclosed |