Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 10/20 | 0.53 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | DRD1 | P21728 | 1/20 | 0.36 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5811741 | 1.00 | KCNH2 (0.53) | KCNH2LIPGPTPN1HTR2AABCB11 | |
| SCHEMBL5293810 | 1.00 | KCNH2 (0.53) | KCNH2LIPGPTPN1HTR2AABCB11 | |
| SCHEMBL4702758 | 0.85 | KCNH2 (0.47) | KCNH2LIPGPTPN1HTR2A | |
| SCHEMBL27978855 | 0.84 | KCNH2 (0.47) | KCNH2LIPGPTPN1ESR1CHRM2 | |
| SCHEMBL3169861 | 0.81 | KCNH2 (0.47) | KCNH2LIPGPTPN1HTR2AABCB11 | |
| SCHEMBL5288629 | 0.77 | KCNH2 (0.63) | KCNH2LIPG | |
| SCHEMBL27633428 | 0.77 | KCNH2 (0.63) | KCNH2LIPG | |
| SCHEMBL2563319 | 0.77 | KCNH2 (0.63) | KCNH2LIPG | |
| SCHEMBL28905757 | 0.77 | KCNH2 (0.63) | KCNH2LIPG | |
| SCHEMBL1168958 | 0.75 | KCNH2 (0.56) | KCNH2LIPGHTT |
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-2006131234-A1 | COSMETIC COMPOSITIONS COMPRISING IONIC LIQUIDS | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 2006-12-14 | — | — | WO | disclosed |