Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 5/20 | 0.50 |
| ▸ | HTR1A | P08908 | 5/20 | 0.50 |
| ▸ | ADRA2A | P08913 | 5/20 | 0.50 |
| ▸ | CHRM1 | P11229 | 5/20 | 0.50 |
| ▸ | DRD1 | P21728 | 5/20 | 0.50 |
| ▸ | ADRA1A | P35348 | 5/20 | 0.50 |
| ▸ | OPRM1 | P35372 | 5/20 | 0.50 |
| ▸ | DRD3 | P35462 | 5/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.50 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.50 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.50 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.50 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.50 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.50 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 8/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 4/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL141530 | 0.87 | CHRM2 (0.62) | CHRM2HTR1AADRA2ACHRM1DRD1 | |
| SCHEMBL29754774 | 0.87 | CHRM2 (0.62) | CHRM2HTR1AADRA2ACHRM1DRD1 | |
| Hydrochloric Acid SCHEMBL30722984 | 0.86 | CHRM2 (0.60) | CHRM2HTR1AADRA2ACHRM1DRD1 | |
| Hydrochloric Acid SCHEMBL3712233 | 0.86 | CHRM2 (0.60) | CHRM2HTR1AADRA2ACHRM1DRD1 | |
| Cyclopropane SCHEMBL3416309 | 0.80 | CYP2D6 (0.39) | CHRM2HTR1AADRA2ACHRM1DRD1 | |
| SCHEMBL11032941 | 0.76 | CHRM2 (0.50) | CHRM2HTR1AADRA2ACHRM1DRD1 | |
| SCHEMBL7349588 | 0.75 | CHRM2 (0.49) | CHRM2HTR1AADRA2ACHRM1DRD1 | |
| Sulfuric Acid Diethyl Ester SCHEMBL7341452 | 0.74 | CHRM2 (0.48) | CHRM2HTR1AADRA2ACHRM1DRD1 | |
| SCHEMBL7343953 | 0.74 | CHRM2 (0.48) | CHRM2HTR1AADRA2ACHRM1DRD1 | |
| SCHEMBL9759321 | 0.73 | CHRM2 (0.47) | CHRM2HTR1AADRA2ACHRM1DRD1 |
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-1433473-B1 | Dyeing composition containing a specific polycationic direct dye, method of dyeing, use and multicompartment device | OREAL (FR) | 2010-11-17 | — | — | EP | claimed |