Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 4/20 | 0.60 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 5/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.45 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 4/20 | 0.44 |
| ▸ | HTT | P42858 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 3/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.37 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.37 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8442358 | 0.88 | TSHR (0.45) | HPGDNPSR1KDM4ESMN1; SMN2TSHR | |
| SCHEMBL8441182 | 0.87 | NPSR1 (0.44) | HPGDNPSR1KDM4ETSHRHSD17B10 | |
| SCHEMBL8437356 | 0.83 | ADORA3 (0.42) | HPGDNPSR1KDM4ETSHRHSD17B10 | |
| SCHEMBL8437325 | 0.82 | KDM4E (0.69) | HPGDNPSR1KDM4ESMN1; SMN2TSHR | |
| SCHEMBL8345995 | 0.82 | NPSR1 (0.89) | HPGDNPSR1KDM4ESMN1; SMN2TSHR | |
| SCHEMBL8441847 | 0.81 | NPSR1 (0.40) | HPGDNPSR1KDM4ESMN1; SMN2TSHR | |
| SCHEMBL8438121 | 0.79 | TSHR (0.41) | HPGDNPSR1KDM4ETSHRHSD17B10 | |
| SCHEMBL8441926 | 0.79 | TSHR (0.42) | HPGDNPSR1KDM4ESMN1; SMN2TSHR | |
| SCHEMBL8437311 | 0.79 | CACNA1F (0.51) | HPGDNPSR1KDM4ESMN1; SMN2TSHR | |
| SCHEMBL8321061 | 0.78 | HPGD (0.41) | HPGDNPSR1KDM4ESMN1; SMN2HSD17B10 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0717036-B1 | Use of 5-acyl-1,4-dihydropyridines for the treatment of diseases of the CNS | BAYER AG (DE) | 1999-03-17 | — | — | EP | claimed |
| EP-0717036-A1 | Use of 5-acyl-1,4-dihydropyridines for the treatment of diseases of the CNS | BAYER AG (DE) | 1996-06-19 | — | — | EP | claimed |
| EP-0717036-B1 | Use of 5-acyl-1,4-dihydropyridines for the treatment of diseases of the CNS | BAYER AG (DE) | 1999-03-17 | — | — | EP | disclosed |
| EP-0717036-A1 | Use of 5-acyl-1,4-dihydropyridines for the treatment of diseases of the CNS | BAYER AG (DE) | 1996-06-19 | — | — | EP | disclosed |