Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1C | Q13936 | 2/20 | 0.36 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CLCN2 | P51788 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.31 |
| ▸ | F2 | P00734 | 1/20 | 0.31 |
| ▸ | F10 | P00742 | 1/20 | 0.31 |
| ▸ | PLAU | P00749 | 1/20 | 0.31 |
| ▸ | PLAT | P00750 | 1/20 | 0.31 |
| ▸ | CDC7 | O00311 | 1/20 | 0.31 |
| ▸ | PLK4 | O00444 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11246227 | 0.82 | MAPK1 (0.41) | ALDH1A1LMNAMAPK1KDM4E | |
| SCHEMBL6696393 | 0.79 | CACNA1C (0.55) | CACNA1CSCN5ACLCN2ALDH1A1CYP3A4 | |
| SCHEMBL10988570 | 0.77 | CDC7 (0.41) | CLCN2S1PR4ALDH1A1SMN1; SMN2CYP3A4 | |
| SCHEMBL11256873 | 0.77 | SCN5A (0.36) | CACNA1CSCN5ACYP1A2S1PR4ALDH1A1 | |
| SCHEMBL6698675 | 0.74 | NLRP3 (0.50) | CACNA1CSCN5AALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL11093462 | 0.74 | CYP1A2 (0.40) | CYP1A2CLCN2ALDH1A1LMNAF2 | |
| SCHEMBL11259523 | 0.72 | ALDH1A1 (0.38) | CYP1A2CLCN2S1PR4ALDH1A1SMN1; SMN2 | |
| Biclodil SCHEMBL1815631 | 0.72 | CYP1A2 (0.49) | CYP1A2LMNAF2F10PLAU | |
| SCHEMBL11248235 | 0.71 | ALDH1A1 (0.42) | ALDH1A1SMN1; SMN2LMNAF2F10 | |
| SCHEMBL11661761 | 0.71 | CACNA1C (0.43) | CACNA1CSCN5AS1PR4ALDH1A1SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4326074-A | ANTIDIARRHEA AGENTS | WILLIAM H. RORER, INC. (US) | 1982-04-20 | — | — | US | disclosed |
| US-4115564-A | Treatment of diarrhea with amidinoureas | WILLIAM H. RORER, INC. (US) | 1978-09-19 | — | — | US | disclosed |