Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MME | P08473 | 2/20 | 0.44 |
| ▸ | ACE | P12821 | 2/20 | 0.44 |
| ▸ | ESR1 | P03372 | 7/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 7/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | KIF11 | P52732 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10071985 | 0.74 | ESR1 (0.42) | ESR1ESR2ALDH1A1CYP3A4SLC6A3 | |
| SCHEMBL656271 | 0.73 | ESR1 (0.49) | ESR1ESR2ALDH1A1CYP3A4SLC6A3 | |
| Bisphenol A SCHEMBL29384032 | 0.69 | CA2 (0.61) | ESR1ESR2ALDH1A1CYP3A4SLC6A3 | |
| SCHEMBL8064735 | 0.68 | ESR1 (0.47) | ESR1ESR2ALDH1A1CYP3A4SLC6A3 | |
| SCHEMBL27980865 | 0.67 | ESR1 (0.50) | ESR1ESR2ALDH1A1CYP3A4SLC6A3 | |
| Bisphenol A SCHEMBL30193354 | 0.67 | ESR1 (0.55) | MMEACEESR1ESR2ALDH1A1 | |
| SCHEMBL3470639 | 0.67 | ESR1 (0.45) | ESR1ESR2ALDH1A1CYP3A4SLC1A1 | |
| SCHEMBL1176816 | 0.67 | ESR1 (0.45) | ESR1ESR2ALDH1A1CYP3A4SLC1A1 | |
| SCHEMBL6302501 | 0.66 | ESR1 (0.46) | ESR1ESR2ALDH1A1CYP3A4SLC6A3 | |
| SCHEMBL3131833 | 0.66 | ESR1 (0.51) | ESR1ESR2ALDH1A1CYP3A4SLC6A3 |
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-2248841-A1 | AROMATIC POLYCARBONATE COMPOSITION AND HOLLOW CONTAINER THEREFROM | MITSUBISHI CHEMICAL CORPORATION (JP) | 2010-11-10 | — | — | EP | disclosed |