Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | ACHE | P22303 | 5/20 | 0.34 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.34 |
| ▸ | ASAH1 | Q13510 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.32 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.32 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.32 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.32 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11057847 | 0.93 | SMN1; SMN2 (0.41) | SMN1; SMN2HTTLMNAACHEASAH1 | |
| SCHEMBL11053216 | 0.89 | SMN1; SMN2 (0.43) | SMN1; SMN2HTTLMNAACHENR1I2 | |
| SCHEMBL11056570 | 0.84 | SMN1; SMN2 (0.37) | SMN1; SMN2LMNAACHENR1I2ALDH1A1 | |
| SCHEMBL11054620 | 0.81 | SMN1; SMN2 (0.44) | SMN1; SMN2HTTLMNANR1I2ASAH1 | |
| SCHEMBL11056986 | 0.80 | ALDH1A1 (0.38) | SMN1; SMN2LMNAACHEALDH1A1L3MBTL1 | |
| SCHEMBL11061902 | 0.78 | SMN1; SMN2 (0.41) | SMN1; SMN2HTTLMNAASAH1ALDH1A1 | |
| SCHEMBL11056098 | 0.78 | SMN1; SMN2 (0.41) | SMN1; SMN2HTTLMNAACHEASAH1 | |
| SCHEMBL11057749 | 0.78 | ALDH1A1 (0.46) | SMN1; SMN2LMNAALDH1A1MAPTNPSR1 | |
| SCHEMBL11057015 | 0.77 | PKM (0.36) | SMN1; SMN2HTTLMNANR1I2ALDH1A1 | |
| SCHEMBL11054052 | 0.76 | ALDH1A1 (0.50) | SMN1; SMN2LMNAALDH1A1MAPTL3MBTL1 |
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 |