Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.50 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.50 |
| ▸ | DRD2 | P14416 | 1/20 | 0.50 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.50 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.50 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.50 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.50 |
| ▸ | HTR2A | P28223 | 1/20 | 0.50 |
| ▸ | HTR2C | P28335 | 1/20 | 0.50 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.50 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.50 |
| ▸ | HRH1 | P35367 | 1/20 | 0.50 |
| ▸ | DRD3 | P35462 | 1/20 | 0.50 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.50 |
| ▸ | HTR2B | P41595 | 1/20 | 0.50 |
| ▸ | MC3R | P41968 | 1/20 | 0.50 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL9421110 | 1.00 | ALDH1A1 (0.50) | ALDH1A1CHRM2ADRA2ACYP2D6CHRM1 | |
| SCHEMBL9421107 | 1.00 | ALDH1A1 (0.50) | ALDH1A1CHRM2ADRA2ACYP2D6CHRM1 | |
| SCHEMBL9579901 | 1.00 | ALDH1A1 (0.50) | ALDH1A1CHRM2ADRA2ACYP2D6CHRM1 | |
| SCHEMBL9421102 | 1.00 | ALDH1A1 (0.50) | ALDH1A1CHRM2ADRA2ACYP2D6CHRM1 | |
| SCHEMBL9421093 | 0.79 | ALDH1A1 (0.39) | ALDH1A1CHRM2ADRA2ACYP2D6CHRM1 | |
| SCHEMBL9421085 | 0.79 | ALDH1A1 (0.39) | ALDH1A1CHRM2ADRA2ACYP2D6CHRM1 | |
| SCHEMBL13803474 | 0.73 | ALDH1A1 (0.54) | ALDH1A1CHRM2ADRA2ACYP2D6CHRM1 | |
| SCHEMBL216973 | 0.72 | ACHE (0.56) | ALDH1A1CHRM2ADRA2ACYP2D6CHRM1 | |
| SCHEMBL6967536 | 0.72 | SLC6A2 (0.63) | ALDH1A1CHRM2ADRA2ACYP2D6CHRM1 | |
| SCHEMBL6967533 | 0.72 | SLC6A2 (0.63) | ALDH1A1CHRM2ADRA2ACYP2D6CHRM1 |
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-0312269-B1 | 3,5-DIHYDROXY-6,8-NONADIENOIC ACIDS AND DERIVATIVES AS HYPOCHOLESTEROLEMIC AGENTS | PFIZER INC. (US) | 1993-06-16 | — | — | EP | disclosed |