Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 7/20 | 0.38 |
| ▸ | CYP2B6 | P20813 | 3/20 | 0.37 |
| ▸ | CYP2E1 | P05181 | 2/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | ERN1 | O75460 | 2/20 | 0.34 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.33 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | PELI1 | Q96FA3 | 2/20 | 0.31 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.31 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.31 |
| ▸ | PTPRC | P08575 | 1/20 | 0.31 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.31 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.31 |
| ▸ | HTR1D | P28221 | 1/20 | 0.31 |
| ▸ | SQLE | Q14534 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9256407 | 1.00 | CYP2A6 (0.38) | CYP2A6CYP2B6CYP2E1KCNH2ERN1 | |
| SCHEMBL9260479 | 0.75 | PELI1 (0.32) | CYP2A6CYP2B6CYP2E1KCNH2ERN1 | |
| SCHEMBL9260467 | 0.75 | PELI1 (0.32) | CYP2A6CYP2B6CYP2E1KCNH2ERN1 | |
| SCHEMBL9251449 | 0.74 | PRMT6 (0.44) | CYP2A6CYP2B6CYP2E1KCNH2ERN1 | |
| SCHEMBL9251453 | 0.74 | PRMT6 (0.44) | CYP2A6CYP2B6CYP2E1KCNH2ERN1 | |
| SCHEMBL6192775 | 0.73 | ERN1 (0.50) | CYP2A6CYP2B6CYP2E1KCNH2ERN1 | |
| SCHEMBL9254956 | 0.72 | HCAR2 (0.49) | CYP2A6CYP2B6CYP2E1KCNH2ERN1 | |
| SCHEMBL9254963 | 0.72 | HCAR2 (0.49) | CYP2A6CYP2B6CYP2E1KCNH2ERN1 | |
| SCHEMBL9052922 | 0.72 | CYP2A6 (0.42) | CYP2A6CYP2B6CYP2E1KCNH2ERN1 | |
| SCHEMBL9247592 | 0.69 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5439932-A | Anticholesterol agents | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1995-08-08 | — | — | US | disclosed |
| US-5306728-A | Substituted amine derivatives having antihyperlipemia activity | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1994-04-26 | — | — | US | disclosed |
| EP-0448078-A2 | Substituted amine derivatives having anti-hyperlipemia activity | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1991-09-25 | — | — | EP | disclosed |