Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | CACNA1D | Q01668 | 3/20 | 0.43 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.43 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.43 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | DHFR | P00374 | 1/20 | 0.40 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6949791 | 0.87 | CACNA1F (0.46) | KDM4EGAACACNA1DCACNA1FCACNA1S | |
| SCHEMBL9359608 | 0.83 | EPHX2 (0.41) | ADORA3GAACACNA1DCACNA1FCACNA1S | |
| SCHEMBL6958489 | 0.83 | CACNA1D (0.39) | ADORA3KDM4EGAACACNA1DCACNA1F | |
| SCHEMBL7322941 | 0.83 | ADORA3 (0.58) | ADORA3KDM4EGAACACNA1DCACNA1F | |
| SCHEMBL9359332 | 0.81 | CACNA1F (0.38) | ADORA3KDM4ECACNA1DCACNA1FCACNA1S | |
| SCHEMBL8955489 | 0.81 | ADORA3 (0.63) | ADORA3KDM4EGAACACNA1DCACNA1F | |
| SCHEMBL6961417 | 0.81 | ALDH1A1 (0.35) | ADORA3KDM4EGAASMN1; SMN2ALDH1A1 | |
| SCHEMBL9359818 | 0.79 | CACNA1F (0.42) | KDM4EGAACACNA1DCACNA1FCACNA1S | |
| SCHEMBL9363639 | 0.78 | CACNA1D (0.41) | KDM4EGAACACNA1DCACNA1FCACNA1S | |
| SCHEMBL10530880 | 0.78 | ADORA3 (0.50) | ADORA3KDM4EGAACACNA1DCACNA1F |
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-0325129-B1 | Disubstituted pyridines | BAYER AG (DE) | 1994-09-07 | — | — | EP | disclosed |
| EP-0325129-A2 | Disubstituted pyridines | BAYER AG (DE) | 1989-07-26 | — | — | EP | disclosed |