Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 2/20 | 0.43 |
| ▸ | MAOB | P27338 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | PDE5A | O76074 | 1/20 | 0.43 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | PDE4A | P27815 | 1/20 | 0.42 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.42 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.42 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL19642610 | 1.00 | KDM4E (0.48) | KDM4ECACNA1HMAOAMAOBNPC1 | |
| SCHEMBL28873447 | 0.91 | KDM4E (0.51) | KDM4ECACNA1HMAOAMAOBNPC1 | |
| SCHEMBL19642564 | 0.91 | HPGD (0.44) | KDM4ECACNA1HMAOAMAOBPTGS2 | |
| SCHEMBL30187431 | 0.91 | HPGD (0.44) | KDM4ECACNA1HMAOAMAOBPTGS2 | |
| SCHEMBL19643410 | 0.90 | MEN1 (0.41) | KDM4ECACNA1HMAOBPDE4APDE4B | |
| SCHEMBL30187456 | 0.90 | MEN1 (0.41) | KDM4ECACNA1HMAOBPDE4APDE4B | |
| SCHEMBL19642572 | 0.90 | KDM4E (0.41) | KDM4ECACNA1HMAOAMAOBPDE5A | |
| SCHEMBL30187450 | 0.90 | KDM4E (0.41) | KDM4ECACNA1HMAOAMAOBPDE5A | |
| SCHEMBL30187392 | 0.90 | MEN1 (0.42) | KDM4ECACNA1HMAOAMAOBNPC1 | |
| SCHEMBL19642470 | 0.90 | MEN1 (0.42) | KDM4ECACNA1HMAOAMAOBNPC1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109863140-B | 3-oxo-2, 6-diphenyl-2, 3-dihydropyridazine-4-carboxamide | 拜耳医药股份有限公司 | 2023-02-21 | — | — | CN | disclosed |