Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 5/20 | 0.45 |
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | DPP4 | P27487 | 2/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | PNMT | P11086 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL31216385 | 0.78 | MAOB (0.47) | TAAR1MAOAMAOBDPP4SLC6A2 | |
| SCHEMBL4576233 | 0.76 | CYP2D6 (0.45) | TAAR1MAOAMAOBCYP2D6SLC6A2 | |
| SCHEMBL6228602 | 0.76 | OPRM1 (0.40) | CYP2D6SLC6A2SLC6A4SLC6A3TDP1 | |
| SCHEMBL7941233 | 0.73 | SLC6A4 (0.44) | CYP2D6DPP4SLC6A2SLC6A4SLC6A3 | |
| Hydrochloric Acid SCHEMBL11111073 | 0.73 | CYP3A4 (0.63) | SLC6A2SLC6A4SLC6A3OPRK1HTR2A | |
| SCHEMBL20876291 | 0.72 | CYP2D6 (0.42) | CYP2D6SLC6A2SLC6A4SLC6A3OPRM1 | |
| SCHEMBL19647190 | 0.72 | SLC6A2 (0.51) | TAAR1MAOAMAOBCYP2D6SLC6A2 | |
| SCHEMBL23491340 | 0.70 | OPRD1 (0.33) | MAOAMAOBCYP2D6SLC6A2SLC6A4 | |
| SCHEMBL12235288 | 0.69 | SLC6A3 (0.71) | CYP2D6SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL24691526 | 0.69 | OPRM1 (0.46) | CYP2D6SLC6A4OPRM1OPRK1OPRL1 |
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-109890208-A | FUNGICIDAL COMPOSITIONS | 先正达参股股份有限公司 | 2019-06-14 | — | — | CN | disclosed |