Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | SPHK2 | Q9NRA0 | 3/20 | 0.31 |
| ▸ | TNNC1 | P63316 | 5/20 | 0.31 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.31 |
| ▸ | SGPL1 | O95470 | 1/20 | 0.31 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.31 |
| ▸ | GPR183 | P32249 | 1/20 | 0.31 |
| ▸ | CERS2 | Q96G23 | 1/20 | 0.31 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.31 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 2/20 | 0.30 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.30 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.30 |
| ▸ | TACR2 | P21452 | 2/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.30 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5616196 | 0.81 | ESR1 (0.48) | KCNH2ESR1ADRA2AADORA3TACR2 | |
| SCHEMBL5616241 | 0.79 | ESR1 (0.52) | KCNH2ESR1ADRA2AADORA3TACR2 | |
| SCHEMBL5616238 | 0.79 | ESR1 (0.52) | KCNH2ESR1ADRA2AADORA3TACR2 | |
| SCHEMBL10245015 | 0.74 | TAAR1 (0.45) | KCNH2PTGS1PTGS2 | |
| SCHEMBL28679219 | 0.74 | KCNH2 (0.41) | KCNH2TNNC1S1PR1SGPL1S1PR4 | |
| SCHEMBL13781500 | 0.72 | CALM1 (0.56) | — | |
| SCHEMBL7913923 | 0.71 | ESR1 (0.59) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL13526966 | 0.71 | MAOB (0.57) | KCNH2TNNC1S1PR1SGPL1S1PR4 | |
| SCHEMBL12561705 | 0.71 | TNNC1 (0.43) | KCNH2SPHK2TNNC1S1PR1SGPL1 | |
| SCHEMBL4742953 | 0.70 | MAOA (0.52) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007127330-A2 | SULFOXY COMPOUNDS FOR USE IN DISINFECTANTS | CERNOFINA, LLC (US) | 2007-11-08 | — | — | WO | disclosed |