Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.68 |
| ▸ | HTR2A | P28223 | 3/20 | 0.39 |
| ▸ | DRD2 | P14416 | 2/20 | 0.39 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.37 |
| ▸ | ABCC9 | O60706 | 2/20 | 0.34 |
| ▸ | ABCC8 | Q09428 | 2/20 | 0.34 |
| ▸ | KCNJ11 | Q14654 | 2/20 | 0.34 |
| ▸ | KCNJ8 | Q15842 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.34 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.34 |
| ▸ | HTR2C | P28335 | 2/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8570741 | 0.87 | KCNH2 (0.53) | KCNH2HTR2ADRD2KCNJ1CYP11B2 | |
| SCHEMBL8569350 | 0.85 | KCNH2 (0.64) | KCNH2HTR2ADRD2KCNJ1CYP11B2 | |
| SCHEMBL4706083 | 0.84 | KCNH2 (0.74) | KCNH2HTR2ADRD2KCNJ1CYP11B2 | |
| SCHEMBL8567782 | 0.84 | KCNH2 (0.50) | KCNH2HTR2ADRD2KCNJ1CYP11B2 | |
| Hydrochloric Acid SCHEMBL8564675 | 0.83 | KCNH2 (0.49) | KCNH2HTR2ADRD2KCNJ1CYP11B2 | |
| SCHEMBL8566025 | 0.82 | KCNH2 (0.80) | KCNH2HTR2ADRD2KCNJ1CYP11B2 | |
| SCHEMBL8831801 | 0.82 | KCNH2 (0.72) | KCNH2HTR2ADRD2KCNJ1CYP11B2 | |
| Hydrochloric Acid SCHEMBL8803788 | 0.81 | KCNH2 (0.71) | KCNH2HTR2ADRD2KCNJ1CYP11B2 | |
| Hydrochloric Acid SCHEMBL8832343 | 0.81 | KCNH2 (0.71) | KCNH2HTR2ADRD2KCNJ1CYP11B2 | |
| SCHEMBL8832003 | 0.81 | KCNH2 (1.00) | KCNH2HTR2ADRD2KCNJ1CYP11B2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0431943-B1 | Spiro(pyran)piperidine derivatives | MERCK & CO INC (US) | 1998-07-15 | — | — | EP | claimed |
| EP-0431943-B1 | Spiro(pyran)piperidine derivatives | MERCK & CO INC (US) | 1998-07-15 | — | — | EP | disclosed |
| US-5633247-A | ANTIARRTHYMIA AGENT | MERCK & CO., INC. (US) | 1997-05-27 | — | — | US | disclosed |
| US-5206240-A | Antiarrhythmia agents | MERCK & CO., INC. (US) | 1993-04-27 | — | — | US | disclosed |