Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | DRD1 | P21728 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27839773 | 0.75 | CYP2D6 (0.48) | KDM4EOPRL1CYP2D6KMT2ACHRM2 | |
| SCHEMBL27681772 | 0.71 | OPRM1 (0.41) | OPRL1HSD11B1OPRM1 | |
| SCHEMBL29065890 | 0.71 | OPRM1 (0.33) | OPRL1CYP2D6KMT2ACHRM2CHRM4 | |
| SCHEMBL21778078 | 0.70 | OPRL1 (0.40) | L3MBTL1KDM4EGAAOPRL1CYP2D6 | |
| SCHEMBL14593219 | 0.69 | CHRM2 (0.59) | OPRL1CYP2D6CYP2C19TSHRHSD11B1 | |
| SCHEMBL27842404 | 0.69 | — | — | |
| SCHEMBL11813176 | 0.69 | OPRL1 (0.65) | OPRL1HSD11B1 | |
| SCHEMBL3609859 | 0.66 | ALDH1A1 (0.66) | OPRL1CYP2D6CYP1A2CYP2C9CYP2C19 | |
| Thiocyanic Acid SCHEMBL27709180 | 0.66 | MAPT (0.32) | — | |
| SCHEMBL28282718 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-105820123-A | Preparation method of oxygen reduction catalyst with non-noble metal doped carbon material | 东南大学 | 2016-08-03 | — | — | CN | disclosed |