Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | ELANE | P08246 | 4/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | HRH2 | P25021 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | MGLL | Q99685 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9364315 | 0.84 | NPSR1 (0.42) | HPGDNPSR1SMN1; SMN2KDM4EGAA | |
| SCHEMBL9220779 | 0.83 | ADRA2A (0.35) | HPGDNPSR1SMN1; SMN2KDM4EGAA | |
| SCHEMBL9120794 | 0.82 | NPSR1 (0.57) | HPGDNPSR1SMN1; SMN2KDM4EGAA | |
| SCHEMBL9367574 | 0.80 | GAA (0.39) | HPGDKDM4EGAAHTTCYP3A4 | |
| SCHEMBL9364015 | 0.78 | HSP90AA1 (0.42) | HPGDNPSR1SMN1; SMN2KDM4EGAA | |
| SCHEMBL9364030 | 0.78 | HPGD (0.43) | HPGDNPSR1SMN1; SMN2KDM4EGAA | |
| SCHEMBL9363815 | 0.75 | NPSR1 (0.48) | HPGDNPSR1SMN1; SMN2KDM4EGAA | |
| SCHEMBL9364552 | 0.75 | ALDH1A1 (0.40) | HPGDNPSR1SMN1; SMN2KDM4EGAA | |
| SCHEMBL9368993 | 0.74 | ADORA3 (0.45) | SMN1; SMN2L3MBTL1HRH2HRH1MGLL | |
| SCHEMBL9364528 | 0.72 | NPSR1 (0.45) | HPGDNPSR1SMN1; SMN2KDM4EGAA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0451654-A2 | Use of N-alkylated 1,4-dihydropyridine carboxylic acid esters as drugs, new compounds and process for their preparation | BAYER AG (DE) | 1991-10-16 | — | — | EP | claimed |
| EP-0451654-B1 | Use of N-alkylated 1,4-dihydropyridine carboxylic acid esters as drugs, new compounds and process for their preparation | BAYER AG (DE) | 1994-09-07 | — | — | EP | disclosed |
| EP-0451654-A2 | Use of N-alkylated 1,4-dihydropyridine carboxylic acid esters as drugs, new compounds and process for their preparation | BAYER AG (DE) | 1991-10-16 | — | — | EP | disclosed |