Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | KCNA5 | P22460 | 4/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.35 |
| ▸ | BLM | P54132 | 2/20 | 0.33 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.33 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.33 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 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 | |
|---|---|---|---|---|
| SCHEMBL21742096 | 0.89 | SMN1; SMN2 (0.40) | CYP2D6CYP1A2CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL21742050 | 0.80 | SMN1; SMN2 (0.40) | CYP2D6CYP1A2CYP2C9SMN1; SMN2L3MBTL1 | |
| SCHEMBL21742089 | 0.79 | CHRM2 (0.42) | CYP2D6CYP1A2CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL21742103 | 0.76 | SMN1; SMN2 (0.44) | CYP2D6CYP1A2CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL21742094 | 0.75 | SMN1; SMN2 (0.37) | CYP2D6CYP1A2CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL21742067 | 0.75 | SMN1; SMN2 (0.37) | CYP2D6CYP1A2CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL21742083 | 0.75 | CHRM2 (0.44) | CYP2D6CYP1A2CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL21742282 | 0.74 | CHRM2 (0.46) | CYP2D6CYP1A2CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL21742023 | 0.72 | CHRM2 (0.42) | CYP2D6CYP1A2CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL21742118 | 0.71 | SMN1; SMN2 (0.42) | CYP2D6CYP1A2CYP19A1CYP2C19SMN1; SMN2 |
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-3611164-A1 | PYRIDONE COMPOUND, AND AGRICULTURAL AND HORTICULTURAL FUNGICIDE HAVING THIS AS ACTIVE COMPONENT | Mitsui Chemicals Agro, Inc. (JP) | 2020-02-19 | — | — | EP | disclosed |