Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | ACHE | P22303 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 4/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11056986 | 0.96 | ALDH1A1 (0.38) | SMN1; SMN2RAB9AACHEALDH1A1ALOX12 | |
| SCHEMBL11057847 | 0.90 | SMN1; SMN2 (0.41) | SMN1; SMN2RAB9AACHEALDH1A1ALOX12 | |
| SCHEMBL11055968 | 0.88 | SMN1; SMN2 (0.39) | SMN1; SMN2ACHEALDH1A1LMNANR1I2 | |
| SCHEMBL11057720 | 0.85 | ALDH1A1 (0.39) | SMN1; SMN2ALDH1A1ALOX12LMNAL3MBTL1 | |
| SCHEMBL11061749 | 0.84 | SMN1; SMN2 (0.40) | SMN1; SMN2ACHEALDH1A1ALOX12LMNA | |
| SCHEMBL11057749 | 0.83 | ALDH1A1 (0.46) | SMN1; SMN2ALDH1A1LMNAPKMNPSR1 | |
| SCHEMBL11054052 | 0.82 | ALDH1A1 (0.50) | SMN1; SMN2RAB9AALDH1A1ALOX12LMNA | |
| SCHEMBL11054620 | 0.78 | SMN1; SMN2 (0.44) | SMN1; SMN2ALDH1A1LMNAL3MBTL1NR1I2 | |
| SCHEMBL11137837 | 0.78 | ALDH1A1 (0.52) | SMN1; SMN2RAB9AALDH1A1ALOX12L3MBTL1 | |
| SCHEMBL11057730 | 0.78 | ALDH1A1 (0.35) | SMN1; SMN2ALDH1A1ALOX12 |
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 |