Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 9/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 7/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.44 |
| ▸ | TACR2 | P21452 | 2/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | SHBG | P04278 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.44 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.44 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | TST | Q16762 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL10389816 | 0.85 | ESR1 (0.50) | ESR1ESR2SLC6A2ADRA2AADORA3 | |
| SCHEMBL7300322 | 0.83 | CNR2 (0.44) | MMEACECPA1ACE2 | |
| SCHEMBL7294571 | 0.78 | CSNK1E (0.50) | — | |
| SCHEMBL983046 | 0.77 | ESR1 (0.55) | ESR1ESR2SLC6A2ADRA2AADORA3 | |
| SCHEMBL10390701 | 0.76 | ESR1 (0.54) | ESR1ESR2SLC6A2ADRA2AADORA3 | |
| SCHEMBL28293993 | 0.76 | ESR1 (0.50) | ESR1ESR2SLC6A2ADRA2AADORA3 | |
| SCHEMBL10971031 | 0.75 | ESR1 (0.53) | ESR1ESR2SLC6A2ADRA2AADORA3 | |
| SCHEMBL29233149 | 0.75 | ESR1 (0.53) | ESR1ESR2SLC6A2ADRA2AADORA3 | |
| SCHEMBL28334190 | 0.75 | ESR1 (0.49) | ESR1ESR2SLC6A2ADRA2AADORA3 | |
| SCHEMBL17082269 | 0.74 | ESR1 (0.53) | ESR1ESR2SLC6A2ADRA2AADORA3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2486097-A1 | CROSS-LINKABLE COMPOSITIONS | Wacker Chemie AG (DE) | 2012-08-15 | — | — | EP | disclosed |
| WO-2004039877-A2 | STABILISING AGENT MIXTURE | BASF AKTIENGESELLSCHAFT (DE) | 2004-05-13 | — | — | WO | disclosed |