Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 6/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.45 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.45 |
| ▸ | CACNA1C | Q13936 | 4/20 | 0.45 |
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | ABCC4 | O15439 | 2/20 | 0.41 |
| ▸ | CACNA1F | O60840 | 2/20 | 0.41 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10914095 | 0.89 | POLB (0.46) | MAPTKMT2AMEN1KDM4ESMN1; SMN2 | |
| SCHEMBL10501976 | 0.87 | PDE1C (0.38) | ADORA3CYP1A2CYP3A4MAPTCYP2C9 | |
| SCHEMBL10502844 | 0.87 | PDE1C (0.38) | ADORA3CYP1A2CYP3A4MAPTCYP2C9 | |
| SCHEMBL10351329 | 0.86 | CYP1A2 (0.41) | ADORA3CYP1A2CYP3A4MAPTCYP2C9 | |
| Alcohol SCHEMBL9690926 | 0.86 | MAPT (0.48) | ADORA3CYP1A2CYP3A4MAPTCYP2C9 | |
| SCHEMBL9690807 | 0.86 | POLB (0.44) | MAPTKMT2AMEN1KDM4ESMN1; SMN2 | |
| SCHEMBL9691359 | 0.86 | POLB (0.44) | MAPTKMT2AMEN1KDM4ESMN1; SMN2 | |
| SCHEMBL11023305 | 0.86 | MTNR1A (0.40) | ADORA3CYP1A2CYP3A4MAPTCYP2C9 | |
| SCHEMBL10647063 | 0.85 | POLB (0.43) | MAPTKMT2AMEN1KDM4ESMN1; SMN2 | |
| SCHEMBL9690786 | 0.84 | MEN1 (0.48) | ADORA3CYP1A2CYP3A4MAPTCYP2C9 |
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-0186028-B1 | OPTICALLY ACTIVE NITRODIHYDROPYRIDINES, PROCESS FOR THEIR PREPARATION AND THEIR USE IN MEDICINES | BAYER AG (DE) | 1990-08-01 | — | — | EP | disclosed |
| EP-0186028-A2 | Optically active nitrodihydropyridines, process for their preparation and their use in medicines | BAYER AG (DE) | 1986-07-02 | — | — | EP | disclosed |