Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | PKM | P14618 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 3/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.36 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11060088 | 0.86 | TP53 (0.42) | ALDH1A1TP53KDM4EPOLBHPGD | |
| SCHEMBL11057730 | 0.84 | ALDH1A1 (0.35) | ALDH1A1GAATP53KDM4EMAPT | |
| SCHEMBL11057847 | 0.84 | SMN1; SMN2 (0.41) | ALDH1A1LMNAPKMNPSR1MAPT | |
| SCHEMBL11053011 | 0.84 | POLB (0.37) | ALDH1A1LMNAGAANPSR1POLB | |
| SCHEMBL11056570 | 0.83 | SMN1; SMN2 (0.37) | ALDH1A1LMNAPKMNPSR1HPGD | |
| SCHEMBL11058384 | 0.82 | ALDH1A1 (0.41) | ALDH1A1LMNAPKMGAANPSR1 | |
| SCHEMBL11096045 | 0.82 | ALDH1A1 (0.41) | ALDH1A1TP53KDM4EPOLBHPGD | |
| SCHEMBL11060096 | 0.80 | ALDH1A1 (0.36) | ALDH1A1LMNAGAATP53MAPT | |
| SCHEMBL11056986 | 0.80 | ALDH1A1 (0.38) | ALDH1A1LMNATP53POLBHPGD | |
| SCHEMBL11051176 | 0.80 | ALDH1A1 (0.32) | ALDH1A1GAAMAPTSMN1; SMN2 |
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 |