Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD1 | P21728 | 6/20 | 0.38 |
| ▸ | DRD2 | P14416 | 5/20 | 0.38 |
| ▸ | F3 | P13726 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | APAF1 | O14727 | 1/20 | 0.37 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 2/20 | 0.36 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.36 |
| ▸ | MTNR1B | P49286 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16772366 | 0.68 | DRD1 (0.48) | DRD1DRD2F3KDM4ELMNA | |
| SCHEMBL2742544 | 0.66 | DRD1 (0.60) | DRD1DRD2F3KDM4ELMNA | |
| SCHEMBL6959755 | 0.66 | CETP (0.44) | DRD1DRD2F3KDM4ELMNA | |
| SCHEMBL4128903 | 0.66 | CETP (0.48) | DRD1DRD2F3KDM4ELMNA | |
| SCHEMBL16774958 | 0.65 | DRD1 (0.46) | DRD1DRD2F3KDM4ELMNA | |
| SCHEMBL20170653 | 0.63 | GAA (0.42) | KDM4ECYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL20170665 | 0.62 | CYP3A4 (0.41) | DRD1DRD2F3KDM4ECYP1A2 | |
| SCHEMBL7363210 | 0.62 | CYP1A2 (0.59) | DRD1DRD2F3KDM4ELMNA | |
| SCHEMBL2463383 | 0.61 | ADRA1A (0.47) | DRD1DRD2F3KDM4ELMNA | |
| SCHEMBL16210119 | 0.61 | PNMT (0.57) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2453895-B1 | (+) - MORPHINANS AS ANTAGONISTS OF TOLL-LIKE RECEPTOR 9 AND THERAPEUTIC USES THEREOF | MALLINCKRODT LLC (US) | 2018-05-23 | — | — | EP | disclosed |