Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 5/20 | 0.53 |
| ▸ | ESR1 | P03372 | 3/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.46 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.44 |
| ▸ | TACR2 | P21452 | 2/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | SHBG | P04278 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 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 |
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 | |
|---|---|---|---|---|
| SCHEMBL15312924 | 0.85 | ALOX5 (0.71) | ALOX5ADRA2ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL4328322 | 0.83 | ESR1 (0.48) | ESR1ESR2ADRA2AADORA3TACR2 | |
| SCHEMBL25337380 | 0.80 | ESR1 (0.45) | ESR1ESR2ADRA2AADORA3TACR2 | |
| SCHEMBL893363 | 0.78 | ALOX5 (0.62) | ALOX5SLC6A3 | |
| SCHEMBL4325564 | 0.75 | ESR1 (0.52) | ESR1ESR2ADRA2ASLC6A2KDM4E | |
| SCHEMBL4328328 | 0.74 | CALM1 (0.46) | ESR1ESR2ADRA2AADORA3TACR2 | |
| SCHEMBL14362172 | 0.73 | DPP4 (0.54) | ALOX5TRPV1DPP4 | |
| SCHEMBL2475962 | 0.72 | ESR1 (0.55) | ESR1ESR2ADRA2AADORA3TACR2 | |
| SCHEMBL1520687 | 0.72 | ALOX5 (0.65) | ALOX5SLC6A3CYP3A4 | |
| SCHEMBL284671 | 0.72 | SMN1; SMN2 (0.69) | ESR1ESR2SLC6A3ALDH1A1LMNA |
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-1963255-A1 | SYNEPHRINE DERIVATIVES USEFUL AS ANTI-INFLAMMATORY AGENTS | UNIVERSITEIT GENT (BE) | 2008-09-03 | — | — | EP | disclosed |
| WO-2007071452-A1 | SYNEPHRINE DERIVATIVES USEFUL AS ANTI-INFLAMMATORY AGENTS | UNIVERSITEIT GENT (BE) | 2007-06-28 | — | — | WO | disclosed |