Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | STS | P08842 | 14/20 | 0.78 |
| ▸ | ESR1 | P03372 | 2/20 | 0.67 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.67 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.67 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.67 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.67 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.67 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.67 |
| ▸ | SHBG | P04278 | 1/20 | 0.67 |
| ▸ | PGR | P06401 | 1/20 | 0.67 |
| ▸ | HTR1A | P08908 | 1/20 | 0.67 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.67 |
| ▸ | AR | P10275 | 1/20 | 0.67 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.67 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.67 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.67 |
| ▸ | UGT1A1 | P22309 | 1/20 | 0.67 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.67 |
| ▸ | PDE4A | P27815 | 1/20 | 0.67 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.67 |
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 | |
|---|---|---|---|---|
| SCHEMBL147038 | 0.92 | STS (0.78) | STSESR1CYP3A4ESR2SLC22A2 | |
| SCHEMBL4903623 | 0.88 | STS (1.00) | STSESR1CYP3A4ESR2SLC22A2 | |
| SCHEMBL4903619 | 0.88 | STS (1.00) | STSESR1CYP3A4ESR2SLC22A2 | |
| SCHEMBL14515129 | 0.87 | STS (0.85) | STSESR1CYP3A4ESR2SLC22A2 | |
| SCHEMBL9404855 | 0.85 | STS (0.75) | STSESR1CYP3A4ESR2SLC22A2 | |
| SCHEMBL15233086 | 0.85 | STS (0.78) | STSESR1CYP3A4ESR2SLC22A2 | |
| SCHEMBL31508217 | 0.85 | STS (0.81) | STSESR1CYP3A4ESR2SLC22A2 | |
| SCHEMBL27892176 | 0.84 | STS (0.77) | STSESR1CYP3A4ESR2SLC22A2 | |
| SCHEMBL31508390 | 0.84 | STS (0.80) | STSESR1CYP3A4ESR2SLC22A2 | |
| SCHEMBL7778060 | 0.84 | STS (0.88) | STS |
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 |
|---|---|---|---|---|---|---|---|
| CN-1211921-A | Benzothiophenes, formulations containing same and process of preparing same | LILLY CO ELI (US) | 1999-03-24 | — | — | CN | disclosed |