Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.55 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.55 |
| ▸ | APP | P05067 | 3/20 | 0.52 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.52 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.52 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.52 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.52 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.52 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.52 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.52 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.52 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.52 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.52 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 3/20 | 0.51 |
| ▸ | MAOA | P21397 | 1/20 | 0.50 |
| ▸ | MAOB | P27338 | 1/20 | 0.50 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.50 |
| ▸ | PLA2G4A | P47712 | 1/20 | 0.48 |
| ▸ | SNCA | P37840 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL14207388 | 0.88 | NPC1 (0.67) | NPC1HSP90AA1APPHDAC3HDAC1 | |
| SCHEMBL3193186 | 0.84 | MAPK14 (0.61) | NPC1HSP90AA1APPHDAC3HDAC1 | |
| SCHEMBL6192092 | 0.81 | HTR6 (0.59) | NPC1HDAC1HDAC2HDAC10HDAC8 | |
| SCHEMBL6086123 | 0.81 | MAPK14 (0.54) | NPC1HSP90AA1RAB9AMAPK14PPARD | |
| SCHEMBL5894002 | 0.80 | MAPK14 (0.53) | NPC1HSP90AA1HDAC3HDAC1HDAC2 | |
| SCHEMBL2828419 | 0.79 | FFAR1 (0.63) | MAPK14PPARDPPARA | |
| SCHEMBL31258068 | 0.79 | NPC1 (0.52) | NPC1HSP90AA1APPHDAC3HDAC1 | |
| SCHEMBL6100496 | 0.78 | ALOX5 (0.61) | NPC1RAB9AMAPK14PPARDPPARA | |
| SCHEMBL15447279 | 0.77 | HDAC8 (0.51) | NPC1HSP90AA1APPHDAC3HDAC1 | |
| SCHEMBL31257977 | 0.77 | HDAC8 (0.51) | NPC1HSP90AA1APPHDAC3HDAC1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108358923-B | Sophoridine pyrrole and indole derivatives, and preparation method and application thereof | 广西大学 | 2020-11-03 | — | — | CN | claimed |
| CN-108358923-A | Sophoridine pyrroles, indole derivatives and the preparation method and application thereof | 广西大学 | 2018-08-03 | — | — | CN | claimed |