Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | DAO | P14920 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.39 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.39 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.39 |
| ▸ | PRMT5 | O14744 | 6/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1699174 | 0.88 | NPC1 (0.51) | NPC1RAB9AL3MBTL1PKMSMN1; SMN2 | |
| SCHEMBL1699242 | 0.83 | L3MBTL1 (0.56) | NPC1RAB9AL3MBTL1PKMSMN1; SMN2 | |
| SCHEMBL1699265 | 0.83 | NPC1 (0.46) | NPC1RAB9AL3MBTL1PKMSMN1; SMN2 | |
| SCHEMBL1699310 | 0.80 | NPC1 (0.59) | NPC1RAB9AL3MBTL1PKMSMN1; SMN2 | |
| SCHEMBL1699258 | 0.78 | L3MBTL1 (0.55) | NPC1RAB9AL3MBTL1PKMSMN1; SMN2 | |
| SCHEMBL1699185 | 0.77 | NPC1 (0.50) | NPC1RAB9AL3MBTL1PKMSMN1; SMN2 | |
| SCHEMBL1699315 | 0.75 | NPC1 (0.50) | NPC1RAB9AL3MBTL1PKMSMN1; SMN2 | |
| SCHEMBL1699264 | 0.74 | MAP3K11 (0.40) | PKMLMNACSNK2A1HPGDKDM4E | |
| SCHEMBL9981622 | 0.74 | NPC1 (0.58) | NPC1RAB9AL3MBTL1PKMSMN1; SMN2 | |
| SCHEMBL1699125 | 0.74 | NPC1 (0.56) | NPC1RAB9AL3MBTL1PKMSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011163355-A1 | FUSED HETEROCYCLIC COMPOUNDS AS PHOSPHODIESTERASES (PDES) INHIBITORS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2011-12-29 | — | — | WO | disclosed |