Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.50 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 3/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | CHIT1 | Q13231 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.41 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL11557047 | 0.91 | SCN5A (0.49) | ALDH1A1SMN1; SMN2ALOX12NLRP3HTT | |
| SCHEMBL11274843 | 0.89 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2ALOX12NLRP3HTT | |
| SCHEMBL10615584 | 0.88 | CACNA1C (0.52) | ALDH1A1SMN1; SMN2ALOX12NLRP3HTT | |
| SCHEMBL9177252 | 0.87 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2ALOX12NLRP3HTT | |
| SCHEMBL11287194 | 0.85 | POLB (0.42) | ALDH1A1POLBMEN1KMT2AMAPT | |
| SCHEMBL11274661 | 0.85 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2ALOX12NLRP3HTT | |
| SCHEMBL11271522 | 0.84 | SCN5A (0.40) | ALDH1A1NLRP3KDM4EALOX15RAB9A | |
| SCHEMBL6698675 | 0.84 | NLRP3 (0.50) | ALDH1A1SMN1; SMN2ALOX12NLRP3HTT | |
| SCHEMBL11284491 | 0.81 | CACNA1C (0.39) | ALDH1A1SMN1; SMN2POLBMEN1KMT2A | |
| SCHEMBL11056404 | 0.81 | CACNA1C (0.54) | ALDH1A1SMN1; SMN2ALOX12NLRP3HTT |
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-4326075-A | ANTIDIARRHEA AGENTS | WILLIAM H. RORER, INC. (US) | 1982-04-20 | — | — | US | disclosed |
| US-4203920-A | ANTIDIARRHEAL | WILLIAM H. RORER, INC. (US) | 1980-05-20 | — | — | US | disclosed |
| US-4147804-A | ANTIARRHYTHMIA AGENTS | WILLIAM H. RORER, INC. (US) | 1979-04-03 | — | — | US | disclosed |
| US-4060635-A | Amidinoureas for treating diarrhea | WILLIAM H. RORER, INC. (US) | 1977-11-29 | — | — | US | disclosed |