Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | PDE1C | Q14123 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | BACE1 | P56817 | 2/20 | 0.38 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.37 |
| ▸ | PLIN1 | O60240 | 1/20 | 0.37 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.37 |
| ▸ | GMNN | O75496 | 1/20 | 0.37 |
| ▸ | KCNK2 | O95069 | 1/20 | 0.37 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.37 |
| ▸ | GSR | P00390 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL3001034 | 0.80 | KDM4E (0.39) | KDM4EHSD17B10ALDH1A1SMN1; SMN2HTT | |
| SCHEMBL3000677 | 0.76 | KDM4E (0.39) | KDM4EHSD17B10ALDH1A1PDE1CTSHR | |
| SCHEMBL6293550 | 0.74 | KDM4E (0.53) | KDM4EHSD17B10ALDH1A1SMN1; SMN2HTT | |
| SCHEMBL10658875 | 0.70 | KDM4E (0.52) | KDM4EHSD17B10ALDH1A1SMN1; SMN2PDE1C | |
| SCHEMBL10657847 | 0.70 | BACE1 (0.53) | KDM4EHSD17B10ALDH1A1SMN1; SMN2PDE1C | |
| SCHEMBL3004313 | 0.67 | ALDH1A1 (0.56) | KDM4EHSD17B10ALDH1A1HTTTSHR | |
| SCHEMBL3000827 | 0.66 | PDE1C (0.45) | ALDH1A1PDE1CADORA3ADORA2A | |
| SCHEMBL10664613 | 0.66 | ADORA3 (0.46) | KDM4EHSD17B10ALDH1A1SMN1; SMN2HTT | |
| SCHEMBL4258340 | 0.66 | BACE1 (0.35) | BACE1CACNA1B | |
| SCHEMBL13209900 | 0.66 | ALDH1A1 (0.39) | KDM4EHSD17B10ALDH1A1SMN1; SMN2HTT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010002483-A1 | OPTIONALLY CONDENSED DIHYDRO PYRIDINE, DIHYDROPYRIMIDINE AND DIHYDRO PYRANE DERIVATIVES ACTING AS LATE SODIUM CHANNEL BLOCKERS | CV THERAPEUTICS, INC. (US) | 2010-01-07 | — | — | WO | disclosed |
| WO-2009006580-A1 | OPTIONALLY CONDENSED DIHYDROPYRIDINE, DIHYDROPYRIMIDINE AND DIHYDROPYRANE DERIVATIVES ACTING AS LATE SODIUM CHANNEL BLOCKERS | CV THERAPEUTICS, INC. (US) | 2009-01-08 | — | — | WO | disclosed |