Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.42 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.42 |
| ▸ | XDH | P47989 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CDK4 | P11802 | 3/20 | 0.41 |
| ▸ | CCND1 | P24385 | 3/20 | 0.41 |
| ▸ | CCNB2 | O95067 | 2/20 | 0.41 |
| ▸ | CDK1 | P06493 | 2/20 | 0.41 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.41 |
| ▸ | CCNB3 | Q8WWL7 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | CRHBP | P24387 | 1/20 | 0.35 |
| ▸ | CRHR2 | Q13324 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2622604 | 0.85 | ALDH1A1 (0.45) | ALDH1A1MAPK1CYP3A4HPGDCRHBP | |
| SCHEMBL21675992 | 0.82 | ALDH1A1 (0.41) | ALDH1A1TRPA1LMNAALOX5MAPK1 | |
| SCHEMBL18345932 | 0.79 | ALDH1A1 (0.43) | ALDH1A1TRPA1LMNAALOX5MAPK1 | |
| SCHEMBL18345930 | 0.79 | ALDH1A1 (0.43) | ALDH1A1TRPA1LMNAALOX5MAPK1 | |
| SCHEMBL8490796 | 0.78 | AHR (0.50) | ALDH1A1TRPA1LMNAALOX5MAPK1 | |
| SCHEMBL9127026 | 0.78 | AHR (0.50) | ALDH1A1TRPA1LMNAALOX5MAPK1 | |
| SCHEMBL3922988 | 0.77 | ALDH1A1 (0.61) | ALDH1A1TRPA1LMNAALOX5MAPK1 | |
| SCHEMBL2089137 | 0.77 | ALDH1A1 (0.61) | ALDH1A1TRPA1LMNAALOX5MAPK1 | |
| SCHEMBL1312098 | 0.74 | ALDH1A1 (0.56) | ALDH1A1CYP3A4HPGDCRHBPCRHR2 | |
| SCHEMBL20144645 | 0.73 | RAPGEF4 (0.38) | ALDH1A1ALOX5CYP3A4HPGDCRHBP |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4487772-A | CARDIOTONIC AGENTS | OTSUKA PHARMACEUTICAL CO. LTD. (JP) | 1984-12-11 | — | — | US | disclosed |
| US-4468402-A | Carbostyril derivatives, process for producing the same and cardiotonic compositions containing the same | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1984-08-28 | — | — | US | disclosed |
| US-4454130-A | CARDIOTONIC, HYPOTENSIVE AGENTS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1984-06-12 | — | — | US | disclosed |