Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 5/20 | 0.61 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.61 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.48 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.48 |
| ▸ | TACR2 | P21452 | 2/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.48 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.48 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | SHBG | P04278 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.48 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.48 |
| ▸ | HTR2C | P28335 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL27411962 | 1.00 | ESR1 (0.61) | ESR1ESR2ADORA3SLC6A2SLC6A3 | |
| SCHEMBL7898061 | 0.98 | ESR1 (0.62) | ESR1ESR2ADORA3SLC6A2SLC6A3 | |
| SCHEMBL983969 | 0.96 | ESR1 (0.55) | ESR1ESR2ADORA3SLC6A2SLC6A3 | |
| SCHEMBL981729 | 0.96 | ESR1 (0.55) | ESR1ESR2ADORA3SLC6A2SLC6A3 | |
| SCHEMBL7771902 | 0.96 | ESR1 (0.55) | ESR1ESR2ADORA3SLC6A2SLC6A3 | |
| SCHEMBL12593949 | 0.96 | ESR1 (0.55) | ESR1ESR2ADORA3SLC6A2SLC6A3 | |
| SCHEMBL8165667 | 0.96 | ESR1 (0.55) | ESR1ESR2ADORA3SLC6A2SLC6A3 | |
| SCHEMBL3227588 | 0.96 | ESR1 (0.55) | ESR1ESR2ADORA3SLC6A2SLC6A3 | |
| SCHEMBL1031840 | 0.96 | ESR1 (0.55) | ESR1ESR2ADORA3SLC6A2SLC6A3 | |
| SCHEMBL982433 | 0.96 | ESR1 (0.55) | ESR1ESR2ADORA3SLC6A2SLC6A3 |
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-0876598-A4 | IMPROVED CHEMILUMINESCENT 1,2-DIOXETANES | TROPIX INC (US) | 2000-01-19 | — | — | EP | claimed |
| EP-0876598-A1 | IMPROVED CHEMILUMINESCENT 1,2-DIOXETANES | TROPIX, INC. (US) | 1998-11-11 | — | — | EP | claimed |
| WO-1997014954-A1 | IMPROVED CHEMILUMINESCENT 1,2-DIOXETANES | TROPIX, INC. (US) | 1997-04-24 | — | — | WO | claimed |