Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TTR | P02766 | 4/20 | 0.76 |
| ▸ | DPP4 | P27487 | 1/20 | 0.76 |
| ▸ | MAOB | P27338 | 1/20 | 0.68 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.63 |
| ▸ | CA12 | O43570 | 1/20 | 0.63 |
| ▸ | CA1 | P00915 | 1/20 | 0.63 |
| ▸ | CA2 | P00918 | 1/20 | 0.63 |
| ▸ | CA7 | P43166 | 1/20 | 0.63 |
| ▸ | CA9 | Q16790 | 1/20 | 0.63 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.63 |
| ▸ | APP | P05067 | 9/20 | 0.59 |
| ▸ | BACE1 | P56817 | 1/20 | 0.57 |
| ▸ | FDPS | P14324 | 1/20 | 0.54 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.50 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.50 |
| ▸ | ESR1 | P03372 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL2388953 | 1.00 | TTR (0.76) | TTRDPP4MAOBCYP3A4CA12 | |
| SCHEMBL2259487 | 0.88 | TTR (0.76) | TTRDPP4MAOBCYP3A4CA12 | |
| SCHEMBL2259482 | 0.88 | TTR (0.76) | TTRDPP4MAOBCYP3A4CA12 | |
| SCHEMBL1713415 | 0.88 | TTR (0.66) | TTRDPP4MAOBCYP3A4CA12 | |
| SCHEMBL1713417 | 0.88 | TTR (0.66) | TTRDPP4MAOBCYP3A4CA12 | |
| SCHEMBL9862625 | 0.87 | TTR (0.64) | TTRDPP4MAOBCYP3A4CA12 | |
| SCHEMBL9862626 | 0.87 | TTR (0.64) | TTRDPP4MAOBCYP3A4CA12 | |
| Ethyl Caffeate SCHEMBL782033 | 0.86 | TTR (1.00) | TTRDPP4MAOBCYP3A4CA12 | |
| Ethyl Caffeate SCHEMBL22196845 | 0.86 | TTR (1.00) | TTRDPP4MAOBCYP3A4CA12 | |
| Ethyl Caffeate SCHEMBL782032 | 0.86 | TTR (1.00) | TTRDPP4MAOBCYP3A4CA12 |
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-5137889-A | Hypotensive agents; coronary vasodilators; calcium antagonists; antiinflammatory agents | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1992-08-11 | — | — | US | disclosed |
| US-5034395-A | Hypotensive agents, carboxylated dihydropyridines | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1991-07-23 | — | — | US | disclosed |
| US-4795814-A | CORONARY VASODILATORS, HYPOTENSIVE AGENTS, ANTIINFLAMMATORY AGENTS, ANTITUMOR AGENTTS, ENZYME INHIBITORS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1989-01-03 | — | — | US | disclosed |
| EP-0145434-A2 | Novel dihydropyridine derivatives and process for preparing the same | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1985-06-19 | — | — | EP | disclosed |