Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.51 |
| ▸ | CACNA1C | Q13936 | 2/20 | 0.50 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | ALOX12 | P18054 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11140670 | 0.93 | HTT (0.46) | HTTCACNA1CSCN5AALDH1A1MAPT | |
| SCHEMBL11054653 | 0.91 | ALDH1A1 (0.58) | HTTALDH1A1MAPTGAAALOX12 | |
| SCHEMBL11137123 | 0.90 | HTT (0.43) | HTTCACNA1CSCN5AALDH1A1MAPT | |
| SCHEMBL11136950 | 0.90 | GAA (0.44) | HTTCACNA1CSCN5AALDH1A1MAPT | |
| SCHEMBL11137877 | 0.90 | HTT (0.43) | HTTCACNA1CSCN5AALDH1A1MAPT | |
| SCHEMBL11055529 | 0.88 | HTT (0.40) | HTTCACNA1CSCN5AALDH1A1MAPT | |
| SCHEMBL11136466 | 0.87 | SMN1; SMN2 (0.44) | HTTCACNA1CSCN5AALDH1A1MAPT | |
| SCHEMBL11134963 | 0.86 | ALDH1A1 (0.46) | HTTCACNA1CSCN5AALDH1A1MAPT | |
| SCHEMBL11134982 | 0.86 | HTT (0.43) | HTTCACNA1CSCN5AALDH1A1MAPT | |
| SCHEMBL10730044 | 0.83 | CACNA1C (0.53) | HTTCACNA1CSCN5AALDH1A1MAPT |
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-4452980-A | DIARRHEA | WILLIAM H. RORER, INC. (US) | 1984-06-05 | — | — | US | disclosed |
| US-4418209-A | ANTIULCER, ANTIARRYTHMIC, ANTIDIARRHEAL, ANTISPASMODIC, ANTIPARASITIC, AND ANTISECRETORY AGENTS | WILLIAM H. RORER, INC. (US) | 1983-11-29 | — | — | US | disclosed |
| US-4246409-A | ANTIDIARRHEAL AGENTS | WILLIAM H. RORER, INC. (US) | 1981-01-20 | — | — | US | disclosed |
| US-4225315-A | Triazinones from amidinoureas | WILLIAM H. RORER, INC. (US) | 1980-09-30 | — | — | US | disclosed |