Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 13/20 | 0.56 |
| ▸ | ESR2 | Q92731 | 13/20 | 0.56 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.43 |
| ▸ | DRD2 | P14416 | 3/20 | 0.41 |
| ▸ | DRD3 | P35462 | 3/20 | 0.41 |
| ▸ | DRD4 | P21917 | 2/20 | 0.41 |
| ▸ | MLNR | O43193 | 1/20 | 0.41 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | NPY1R | P25929 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8504550 | 1.00 | ESR1 (0.56) | ESR1ESR2OPRM1DRD2DRD3 | |
| SCHEMBL8475554 | 1.00 | ESR1 (0.56) | ESR1ESR2OPRM1DRD2DRD3 | |
| SCHEMBL8475544 | 1.00 | ESR1 (0.56) | ESR1ESR2OPRM1DRD2DRD3 | |
| SCHEMBL8480066 | 0.95 | ESR1 (0.63) | ESR1ESR2OPRM1DRD2DRD3 | |
| SCHEMBL8504338 | 0.95 | ESR1 (0.63) | ESR1ESR2OPRM1DRD2DRD3 | |
| SCHEMBL8480069 | 0.95 | ESR1 (0.63) | ESR1ESR2OPRM1DRD2DRD3 | |
| SCHEMBL8480064 | 0.95 | ESR1 (0.63) | ESR1ESR2OPRM1DRD2DRD3 | |
| SCHEMBL8480543 | 0.94 | ESR1 (0.64) | ESR1ESR2OPRM1DRD2DRD3 | |
| SCHEMBL8482820 | 0.94 | ESR1 (0.52) | ESR1ESR2OPRM1DRD2DRD3 | |
| SCHEMBL8480954 | 0.94 | ESR1 (0.52) | ESR1ESR2OPRM1DRD2DRD3 |
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-0937061-A1 | NOVEL $i(CIS)-3,4-CHROMAN DERIVATIVES USEFUL IN THE PREVENTION OR TREATMENT OF ESTROGEN RELATED DISEASES OR SYNDROMES | NOVO NORDISK A/S (DK) | 1999-08-25 | — | — | EP | disclosed |
| US-5919817-A | NOVEL HYDROXY SUBSTITUTED CIS-3,4-DI((SUBSTITUTED)PHENYL) CHROMANE DERIVATIVES | NOVO NORDISK A/S (DK) | 1999-07-06 | — | — | US | disclosed |
| WO-1998018777-A1 | NOVEL CIS-3,4-CHROMAN DERIVATIVES USEFUL IN THE PREVENTION OR TREATMENT OF ESTROGEN RELATED DISEASES OR SYNDROMES | NOVO NORDISK A/S (DK) | 1998-05-07 | — | — | WO | disclosed |