Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.34 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.34 |
| ▸ | HRH2 | P25021 | 2/20 | 0.34 |
| ▸ | HTR2A | P28223 | 2/20 | 0.34 |
| ▸ | HTR2C | P28335 | 2/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.34 |
| ▸ | HRH1 | P35367 | 2/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.34 |
| ▸ | DRD3 | P35462 | 2/20 | 0.34 |
| ▸ | HTR2B | P41595 | 2/20 | 0.34 |
| ▸ | HTR6 | P50406 | 2/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL21495736 | 0.88 | ESR1 (0.36) | CYP2D6ADRA2ACHRM2CHRM4CHRM5 | |
| SCHEMBL21495735 | 0.88 | ESR1 (0.36) | CYP2D6ADRA2ACHRM2CHRM4CHRM5 | |
| SCHEMBL21495253 | 0.88 | CYP2D6 (0.35) | CYP2D6ADRA2ACHRM2CHRM4CHRM5 | |
| SCHEMBL21495254 | 0.88 | CYP2D6 (0.35) | CYP2D6ADRA2ACHRM2CHRM4CHRM5 | |
| SCHEMBL21495441 | 0.85 | CYP2C19 (0.31) | CYP3A4CYP2C19CYP2C9 | |
| SCHEMBL21495440 | 0.85 | CYP2C19 (0.31) | CYP3A4CYP2C19CYP2C9 | |
| SCHEMBL2985090 | 0.81 | AOC3 (0.30) | — | |
| SCHEMBL2985087 | 0.81 | AOC3 (0.30) | — | |
| SCHEMBL21495454 | 0.81 | AOC3 (0.33) | LMNASMN1; SMN2 | |
| SCHEMBL21495452 | 0.81 | AOC3 (0.33) | LMNASMN1; 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-3525588-B1 | 4-SUBSTITUTED PHENYLAMIDINE DERIVATIVES AND THEIR USE TO PROTECT CROPS BY FIGHTING UNDESIRED PHYTOPATHOGENIC MICOORGANISMS | PI INDUSTRIES LTD (IN) | 2024-04-24 | — | — | EP | claimed |