Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 4/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.49 |
| ▸ | HTR2A | P28223 | 5/20 | 0.48 |
| ▸ | DRD2 | P14416 | 4/20 | 0.48 |
| ▸ | HTR2C | P28335 | 3/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 6/20 | 0.42 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.38 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8566857 | 0.75 | ADRA1D (0.47) | HTR2ADRD2HTR2CKCNH2 | |
| SCHEMBL8563145 | 0.73 | EPHX2 (0.51) | EPHX2EPHX1HTR2AKCNH2 | |
| SCHEMBL12695212 | 0.72 | EPHX2 (0.78) | EPHX2CYP2C9CYP2D6EPHX1GPR119 | |
| Hydrochloric Acid SCHEMBL8912554 | 0.72 | EPHX2 (0.52) | EPHX2CYP2C9CYP2D6EPHX1HTR2A | |
| SCHEMBL8565545 | 0.70 | ADRA1D (0.66) | KCNH2 | |
| SCHEMBL8564077 | 0.70 | ADRA1D (0.66) | KCNH2 | |
| SCHEMBL8010281 | 0.70 | DRD2 (0.74) | EPHX2EPHX1HTR2ADRD2HTR2C | |
| SCHEMBL12695002 | 0.69 | EPHX2 (1.00) | EPHX2CYP2C9CYP2D6EPHX1GPR119 | |
| SCHEMBL19838801 | 0.68 | HTR2A (0.71) | EPHX2EPHX1HTR2ADRD2HTR2C | |
| SCHEMBL8576957 | 0.66 | DRD2 (0.67) | HTR2ADRD2HTR2CKCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |