Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 7/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.48 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.48 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.48 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.48 |
| ▸ | DRD1 | P21728 | 2/20 | 0.48 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.48 |
| ▸ | DRD3 | P35462 | 2/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.48 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.48 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.48 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.48 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.48 |
| ▸ | HTR2A | P28223 | 1/20 | 0.48 |
| ▸ | HTR2C | P28335 | 1/20 | 0.48 |
| ▸ | HRH1 | P35367 | 1/20 | 0.48 |
| ▸ | HTR2B | P41595 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL16101680 | 0.85 | KCNA5 (0.53) | CYP2D6CYP2C19CYP3A4CYP2C9KCNA5 | |
| SCHEMBL3919536 | 0.74 | OPRM1 (0.78) | CYP2D6KCNH2CHRM2ADRA2ACHRM1 | |
| SCHEMBL8175607 | 0.74 | OPRM1 (0.78) | CYP2D6KCNH2CHRM2ADRA2ACHRM1 | |
| SCHEMBL7977689 | 0.74 | OPRM1 (0.78) | CYP2D6KCNH2CHRM2ADRA2ACHRM1 | |
| SCHEMBL8186671 | 0.74 | OPRM1 (0.78) | CYP2D6KCNH2CHRM2ADRA2ACHRM1 | |
| SCHEMBL16226061 | 0.70 | CYP2D6 (1.00) | CYP2D6KCNH2CHRM2ADRA2ACHRM1 | |
| SCHEMBL7264542 | 0.70 | CYP2D6 (1.00) | CYP2D6KCNH2CHRM2ADRA2ACHRM1 | |
| SCHEMBL6706135 | 0.70 | CYP2D6 (1.00) | CYP2D6KCNH2CHRM2ADRA2ACHRM1 | |
| SCHEMBL6047023 | 0.68 | CES2 (0.43) | CYP2D6SLC6A2LMNACES2CES1 | |
| SCHEMBL16306975 | 0.67 | CYP2D6 (0.83) | CYP2D6KCNH2CHRM2ADRA2ACHRM1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1014999-A1 | CATIONIC POLYMERS AS TOXIN-BINDING AGENTS | GELTEX PHARMACEUTICALS, INC. (US) | 2000-07-05 | — | — | EP | disclosed |
| WO-1999015186-A1 | CATIONIC POLYMERS AS TOXIN-BINDING AGENTS | GELTEX PHARMACEUTICALS, INC. (US) | 1999-04-01 | — | — | WO | disclosed |