Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.58 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4881281 | 1.00 | HRH3 (0.65) | HRH3SMN1; SMN2KEAP1CYP1A2MAPK1 | |
| SCHEMBL1099069 | 1.00 | HRH3 (0.65) | HRH3SMN1; SMN2KEAP1CYP1A2MAPK1 | |
| SCHEMBL15650409 | 1.00 | HRH3 (0.65) | HRH3SMN1; SMN2KEAP1CYP1A2MAPK1 | |
| SCHEMBL40664 | 1.00 | HRH3 (0.65) | HRH3SMN1; SMN2KEAP1CYP1A2MAPK1 | |
| Hydrochloric Acid SCHEMBL4653699 | 0.97 | HRH3 (0.62) | HRH3SMN1; SMN2KEAP1CYP1A2MAPK1 | |
| Hydrochloric Acid SCHEMBL2674472 | 0.97 | HRH3 (0.62) | HRH3SMN1; SMN2KEAP1CYP1A2MAPK1 | |
| SCHEMBL13876470 | 0.97 | SMN1; SMN2 (0.61) | HRH3SMN1; SMN2KEAP1CYP1A2MAPK1 | |
| SCHEMBL291327 | 0.97 | — | — | |
| SCHEMBL6276732 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL2673564 | 0.94 | KEAP1 (0.58) | HRH3SMN1; SMN2KEAP1ALOX15SIGMAR1 |
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-4724235-A | N-(arylthioalkyl)-N'-(aminoalkyl)ureas useful in the treatment of arrhythmia | A. H. ROBINS COMPANY, INCORPORATED (US) | 1988-02-09 | — | — | US | disclosed |
| US-4597902-A | TREATMENT OF CARDIAC ARRHYTHMIAS | A. H. ROBINS COMPANY, INCORPORATED (US) | 1986-07-01 | — | — | US | disclosed |