Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.55 |
| ▸ | SIGMAR1 | Q99720 | 10/20 | 0.55 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.52 |
| ▸ | MAOB | P27338 | 1/20 | 0.50 |
| ▸ | EBP | Q15125 | 3/20 | 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 | |
|---|---|---|---|---|
| Oxalic Acid SCHEMBL10689565 | 0.92 | TAAR1 (0.49) | TAAR1SIGMAR1AOC3MAOBEBP | |
| SCHEMBL13359819 | 0.83 | SIGMAR1 (0.58) | TAAR1SIGMAR1AOC3EBP | |
| Demelverine SCHEMBL1516521 | 0.81 | SIGMAR1 (0.76) | TAAR1SIGMAR1AOC3 | |
| SCHEMBL5149201 | 0.81 | TAAR1 (0.55) | TAAR1SIGMAR1AOC3 | |
| SCHEMBL1176965 | 0.81 | MAOA (0.67) | TAAR1SIGMAR1AOC3MAOB | |
| SCHEMBL10684904 | 0.80 | PYCR1 (0.66) | SIGMAR1AOC3MAOB | |
| SCHEMBL25852812 | 0.80 | TAAR1 (0.63) | TAAR1SIGMAR1AOC3 | |
| Hydrochloric Acid SCHEMBL28077090 | 0.79 | LMNA (0.68) | TAAR1SIGMAR1AOC3MAOB | |
| SCHEMBL9768687 | 0.79 | SIGMAR1 (0.73) | TAAR1SIGMAR1AOC3 | |
| SCHEMBL4428980 | 0.78 | SIGMAR1 (0.54) | TAAR1SIGMAR1AOC3MAOBEBP |
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 |
|---|---|---|---|---|---|---|---|
| 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 |
| EP-0066415-B1 | N-(ARYLTHIOALKYL)-N'-(AMINOALKYL)UREAS | A.H. ROBINS COMPANY, INCORPORATED (US) | 1985-10-02 | — | — | EP | disclosed |
| EP-0066415-A2 | N-(arylthioalkyl)-N'-(aminoalkyl)ureas | A.H. ROBINS COMPANY, INCORPORATED (US) | 1982-12-08 | — | — | EP | disclosed |