Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.46 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | F13A1 | P00488 | 1/20 | 0.44 |
| ▸ | TGM2 | P21980 | 1/20 | 0.44 |
| ▸ | TGM1 | P22735 | 1/20 | 0.44 |
| ▸ | JAK2 | O60674 | 1/20 | 0.44 |
| ▸ | JAK1 | P23458 | 1/20 | 0.44 |
| ▸ | SYK | P43405 | 1/20 | 0.43 |
| ▸ | CTSL | P07711 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28560717 | 1.00 | PDE4B (0.54) | PDE4BKMT2AL3MBTL1SMN1; SMN2NPC1 | |
| SCHEMBL25568259 | 0.91 | JAK2 (0.48) | PDE4BL3MBTL1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL523500 | 0.90 | PDE4B (0.54) | PDE4BKMT2AL3MBTL1SMN1; SMN2NPC1 | |
| SCHEMBL523499 | 0.90 | PDE4B (0.54) | PDE4BKMT2AL3MBTL1SMN1; SMN2NPC1 | |
| SCHEMBL12527110 | 0.90 | PDE4B (0.54) | PDE4BKMT2AL3MBTL1SMN1; SMN2NPC1 | |
| SCHEMBL523841 | 0.90 | PDE4B (0.54) | PDE4BKMT2AL3MBTL1SMN1; SMN2NPC1 | |
| SCHEMBL3547026 | 0.90 | PDE4B (0.54) | PDE4BKMT2AL3MBTL1SMN1; SMN2NPC1 | |
| SCHEMBL5744759 | 0.88 | PDE4B (0.52) | PDE4BKMT2AL3MBTL1SMN1; SMN2NPC1 | |
| SCHEMBL5744756 | 0.88 | PDE4B (0.52) | PDE4BKMT2AL3MBTL1SMN1; SMN2NPC1 | |
| SCHEMBL5744757 | 0.88 | PDE4B (0.52) | PDE4BKMT2AL3MBTL1SMN1; SMN2NPC1 |
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-112805280-A | Heteroaryl compounds for the treatment of huntington's disease | PTC医疗公司 | 2021-05-14 | — | — | CN | disclosed |