Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 15/20 | 0.69 |
| ▸ | ESR2 | Q92731 | 8/20 | 0.69 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.53 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.53 |
| ▸ | PGR | P06401 | 1/20 | 0.53 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.53 |
| ▸ | HTR1A | P08908 | 1/20 | 0.53 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.53 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.53 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.53 |
| ▸ | DRD1 | P21728 | 1/20 | 0.53 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.53 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.53 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.53 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.53 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.53 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.53 |
| ▸ | DRD3 | P35462 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL7941540 | 0.99 | ESR1 (0.71) | ESR1ESR2KCNH2HRH3PGR | |
| SCHEMBL9152189 | 0.91 | ESR1 (0.84) | ESR1ESR2 | |
| SCHEMBL30076531 | 0.88 | ESR1 (0.89) | ESR1ESR2 | |
| SCHEMBL8486984 | 0.88 | ESR1 (0.68) | ESR1ESR2KCNH2HRH3LTA4H | |
| SCHEMBL6669000 | 0.87 | ESR1 (0.69) | ESR1ESR2KCNH2HRH3LTA4H | |
| SCHEMBL29362450 | 0.87 | ESR1 (0.69) | ESR1ESR2KCNH2HRH3LTA4H | |
| SCHEMBL9153745 | 0.83 | ESR1 (0.98) | ESR1ESR2 | |
| SCHEMBL7943653 | 0.82 | ESR1 (1.00) | ESR1ESR2 | |
| Hydrochloric Acid SCHEMBL8425147 | 0.81 | ESR1 (0.72) | ESR1ESR2 | |
| Hydrochloric Acid SCHEMBL8429229 | 0.81 | ESR1 (0.98) | ESR1ESR2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0470310-B1 | Novel benzopyrans and process for their production | COUNCIL SCIENT IND RES (IN) | 1995-11-29 | — | — | EP | disclosed |
| US-5254568-A | Benzopyrans as antiestrogenic agents | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 1993-10-19 | — | — | US | disclosed |
| EP-0470310-A1 | Novel benzopyrans and process for their production | Council of Scientific and Industrial Research (IN) | 1992-02-12 | — | — | EP | disclosed |