Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | PPARG | P37231 | 1/20 | 0.42 |
| ▸ | PPARA | Q07869 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | HTR7 | P34969 | 3/20 | 0.41 |
| ▸ | MC4R | P32245 | 1/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.40 |
| ▸ | ACP3 | P15309 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14219885 | 1.00 | POLB (0.51) | POLBMAOBESR1ESR2CYP19A1 | |
| SCHEMBL14219378 | 1.00 | POLB (0.51) | POLBMAOBESR1ESR2CYP19A1 | |
| SCHEMBL14219295 | 0.95 | POLB (0.48) | POLBESR1ESR2CYP19A1CYP3A4 | |
| SCHEMBL14219955 | 0.95 | POLB (0.48) | POLBESR1ESR2CYP19A1CYP3A4 | |
| SCHEMBL14219380 | 0.86 | POLB (0.45) | POLBMAOBCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL14219897 | 0.86 | POLB (0.45) | POLBMAOBCYP19A1CYP3A4CYP2D6 | |
| SCHEMBL14220014 | 0.86 | POLB (0.45) | POLBMAOBCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL14219554 | 0.85 | PDPK1 (0.40) | POLBESR1ESR2SIGMAR1ACP3 | |
| SCHEMBL14219895 | 0.85 | PDPK1 (0.40) | POLBESR1ESR2SIGMAR1ACP3 | |
| SCHEMBL14219567 | 0.84 | SLC6A2 (0.44) | MAOBESR1ESR2CYP2D6CYP2C19 |
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-1650285-B1 | Liquid crystal composition containing an optically active compound and liquid crystal electro-optical element | SEIMI CHEM KK (JP) | 2008-04-30 | — | — | EP | disclosed |