Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 4/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.47 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.44 |
| ▸ | HTR1A | P08908 | 2/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.44 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.44 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9691902 | 0.94 | PDE1C (0.49) | MEN1KMT2AALDH1A1PDE1CSIRT1 | |
| SCHEMBL9691359 | 0.88 | POLB (0.44) | MEN1KMT2AALDH1A1SIRT1HTR1A | |
| SCHEMBL9691807 | 0.86 | SLC1A5 (0.44) | HTR1AADRA1AADRA1DADRA1BMAPT | |
| SCHEMBL9691796 | 0.86 | HTR6 (0.43) | SIRT1LMNAFFAR1MAOAMAOB | |
| SCHEMBL10914095 | 0.85 | POLB (0.46) | MEN1KMT2AALDH1A1SIRT1HTR1A | |
| SCHEMBL10368285 | 0.84 | ADORA3 (0.45) | MEN1KMT2AALDH1A1PDE1CSIRT1 | |
| SCHEMBL9690850 | 0.84 | GAA (0.40) | KMT2AALDH1A1SIRT1MAPTPOLB | |
| SCHEMBL10817678 | 0.84 | ALDH1A1 (0.46) | MEN1KMT2AALDH1A1PDE1CCYP19A1 | |
| SCHEMBL9689534 | 0.84 | FFAR4 (0.44) | ALDH1A1CACNA1CMAOB | |
| SCHEMBL9691648 | 0.83 | TP53 (0.41) | MEN1KMT2AALDH1A1SIRT1MAPT |
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-A1 | Dihydropyridines with a positive inotropic activity, their use in pharmaceutical preparations, and processes for their preparation | BAYER AG (DE) | 1983-02-16 | — | — | EP | disclosed |