Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.40 |
| ▸ | TACR2 | P21452 | 2/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | SHBG | P04278 | 1/20 | 0.40 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.40 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | TST | Q16762 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9580333 | 0.87 | ESR1 (0.46) | ESR1CYP3A4ADRA2AADORA3TACR2 | |
| SCHEMBL10501772 | 0.78 | ESR1 (0.47) | ESR1CYP3A4ADRA2AADORA3TACR2 | |
| SCHEMBL10594275 | 0.76 | GCGR (0.41) | ESR1CYP3A4TP53GCGRESR2 | |
| SCHEMBL2697200 | 0.72 | CYP3A4 (0.53) | ESR1CYP3A4ADRA2AADORA3TACR2 | |
| SCHEMBL9862540 | 0.71 | ESR1 (0.39) | ESR1CYP3A4ADRA2AADORA3TACR2 | |
| SCHEMBL2046834 | 0.71 | TYR (0.64) | ESR1CYP3A4ADRA2AADORA3TACR2 | |
| SCHEMBL2045088 | 0.71 | TYR (0.64) | ESR1CYP3A4ADRA2AADORA3TACR2 | |
| SCHEMBL10435018 | 0.70 | GPR3 (0.56) | ESR1CYP3A4ADRA2AADORA3TACR2 | |
| SCHEMBL20561695 | 0.70 | ESR1 (0.53) | ESR1CYP3A4ADRA2AADORA3TACR2 | |
| SCHEMBL10641700 | 0.69 | ESR1 (0.44) | ESR1CYP3A4ADRA2AADORA3TACR2 |
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-0346014-B1 | Therapeutic product for the treatment of peri- or postmenopausal conditions | ZENECA LTD (GB) | 1994-08-03 | — | — | EP | disclosed |