Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE1C | Q14123 | 1/20 | 0.49 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 5/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | CACNA1F | O60840 | 8/20 | 0.46 |
| ▸ | CACNA1D | Q01668 | 8/20 | 0.46 |
| ▸ | CACNA1S | Q13698 | 8/20 | 0.46 |
| ▸ | CACNA1C | Q13936 | 8/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9690786 | 0.94 | MEN1 (0.48) | PDE1CADORA3MEN1KMT2AALDH1A1 | |
| SCHEMBL9691516 | 0.84 | ADORA3 (0.44) | PDE1CADORA3MEN1KMT2AALDH1A1 | |
| SCHEMBL11004215 | 0.82 | PDE1C (0.56) | PDE1CADORA3MEN1KMT2AALDH1A1 | |
| SCHEMBL11004220 | 0.82 | PDE1C (0.56) | PDE1CADORA3MEN1KMT2AALDH1A1 | |
| SCHEMBL9691692 | 0.82 | KMT2A (0.43) | MEN1KMT2AALDH1A1MAPTPOLB | |
| SCHEMBL9691359 | 0.81 | POLB (0.44) | MEN1KMT2AALDH1A1MAPTPOLB | |
| SCHEMBL10817795 | 0.81 | ABCB1 (0.46) | MAPT | |
| SCHEMBL11371616 | 0.80 | CACNA1F (0.66) | PDE1CADORA3MEN1KMT2ACACNA1F | |
| SCHEMBL9691807 | 0.80 | SLC1A5 (0.44) | MAPTFFAR1 | |
| SCHEMBL9691796 | 0.80 | HTR6 (0.43) | LMNAFFAR1SIRT1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0071819-B2 | DIHYDROPYRIDINES WITH A POSITIVE INOTROPIC ACTIVITY, THEIR USE IN PHARMACEUTICAL PREPARATIONS, AND PROCESSES FOR THEIR PREPARATION | BAYER AG (DE) | 1992-06-10 | — | — | EP | disclosed |
| EP-0071819-B1 | DIHYDROPYRIDINES WITH A POSITIVE INOTROPIC ACTIVITY, THEIR USE IN PHARMACEUTICAL PREPARATIONS, AND PROCESSES FOR THEIR PREPARATION | BAYER AG (DE) | 1987-04-22 | — | — | EP | disclosed |