Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 3/20 | 0.50 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.50 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.50 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.46 |
| ▸ | PTPRC | P08575 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | ERN1 | O75460 | 2/20 | 0.40 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.40 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.40 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.37 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.37 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3966226 | 0.81 | CYP2A6 (0.50) | CYP2A6CYP2B6CYP2E1PRMT6PTPRC | |
| SCHEMBL38650917 | 0.80 | CYP2E1 (0.48) | CYP2A6CYP2B6CYP2E1PRMT6PTPRC | |
| SCHEMBL4350314 | 0.80 | CYP2A6 (0.68) | CYP2A6CYP2B6CYP2E1PRMT6PTPRC | |
| SCHEMBL38650731 | 0.78 | CNR1 (0.47) | CYP2A6CYP2B6CYP2E1PRMT6PTPRC | |
| SCHEMBL9253347 | 0.77 | PRMT6 (0.43) | CYP2A6CYP2B6CYP2E1PRMT6PTPRC | |
| SCHEMBL4191595 | 0.76 | RXRA (0.47) | CYP3A4CYP2C9ALOX5 | |
| SCHEMBL3997707 | 0.75 | — | — | |
| SCHEMBL4442916 | 0.75 | HSD17B1 (0.58) | CYP2A6CYP2B6CYP2E1PRMT6KCNH2 | |
| SCHEMBL28164029 | 0.74 | CYP2A6 (0.82) | CYP2A6CYP2B6CYP2E1PRMT6PTPRC | |
| SCHEMBL20490346 | 0.74 | HDAC4 (0.58) | CYP2A6CYP2B6CYP2E1PRMT6PTPRC |
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 |
|---|---|---|---|---|---|---|---|
| US-4426524-A | Heterocyclic substituted benzyl alcohol, insecticidal ester derivatives, and intermediates | FMC CORPORATION (US) | 1984-01-17 | — | — | US | disclosed |