Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 7/20 | 0.60 |
| ▸ | BCHE | P06276 | 4/20 | 0.50 |
| ▸ | DRD2 | P14416 | 2/20 | 0.50 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.50 |
| ▸ | DRD3 | P35462 | 2/20 | 0.50 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.50 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.50 |
| ▸ | ACHE | P22303 | 2/20 | 0.49 |
| ▸ | MAOB | P27338 | 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 | |
|---|---|---|---|---|
| SCHEMBL8720381 | 1.00 | KCNH2 (0.60) | KCNH2BCHEDRD2OPRM1DRD3 | |
| SCHEMBL8722891 | 1.00 | KCNH2 (0.60) | KCNH2BCHEDRD2OPRM1DRD3 | |
| SCHEMBL7764447 | 1.00 | KCNH2 (0.60) | KCNH2BCHEDRD2OPRM1DRD3 | |
| SCHEMBL7766004 | 1.00 | KCNH2 (0.60) | KCNH2BCHEDRD2OPRM1DRD3 | |
| SCHEMBL8720400 | 1.00 | KCNH2 (0.60) | KCNH2BCHEDRD2OPRM1DRD3 | |
| SCHEMBL8723382 | 1.00 | KCNH2 (0.60) | KCNH2BCHEDRD2OPRM1DRD3 | |
| SCHEMBL7130458 | 0.93 | KCNH2 (0.54) | KCNH2BCHEDRD2OPRM1DRD3 | |
| SCHEMBL12126326 | 0.87 | KCNH2 (0.72) | KCNH2BCHEOPRM1DRD3ACHE | |
| SCHEMBL12126534 | 0.87 | KCNH2 (0.72) | KCNH2BCHEOPRM1DRD3ACHE | |
| SCHEMBL9278088 | 0.87 | KCNH2 (0.72) | KCNH2BCHEOPRM1DRD3ACHE |
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-0825175-B1 | Quaternary ammonium disinfectant | NICCA CHEMICAL CO (JP) | 2001-06-13 | — | — | EP | disclosed |
| EP-0825175-A1 | Quaternary ammonium disinfectant | NICCA CHEMICAL CO., LTD. (JP) | 1998-02-25 | — | — | EP | disclosed |