Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.46 |
| ▸ | RAB9A | P51151 | 5/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | ALOX5 | P09917 | 5/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 5/20 | 0.42 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.41 |
| ▸ | PPARD | Q03181 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | SCD | O00767 | 1/20 | 0.38 |
| ▸ | AKR1B1 | P15121 | 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 | |
|---|---|---|---|---|
| SCHEMBL29016676 | 0.84 | CSNK1D (0.40) | RAB9AEPHX2PPARDMAPTAKR1B1 | |
| SCHEMBL30370521 | 0.84 | CSNK1D (0.40) | RAB9AEPHX2PPARDMAPTAKR1B1 | |
| SCHEMBL30370401 | 0.79 | GPR52 (0.43) | NPC1RAB9ASMN1; SMN2MAPTALDH1A1 | |
| SCHEMBL29016638 | 0.79 | GPR52 (0.43) | NPC1RAB9ASMN1; SMN2MAPTALDH1A1 | |
| SCHEMBL30370383 | 0.78 | CSNK1D (0.40) | NPC1RAB9ASMN1; SMN2MAPK1KMT2A | |
| SCHEMBL29016639 | 0.78 | CSNK1D (0.40) | NPC1RAB9ASMN1; SMN2MAPK1KMT2A | |
| SCHEMBL29016594 | 0.76 | MAOB (0.51) | NPC1RAB9ASMN1; SMN2L3MBTL1MAPK1 | |
| SCHEMBL29016544 | 0.76 | NPC1 (0.49) | NPC1RAB9ASMN1; SMN2L3MBTL1MAPK1 | |
| SCHEMBL29016575 | 0.74 | MRGPRX4 (0.34) | SMN1; SMN2KMT2AMRGPRX4MAPTHTT | |
| SCHEMBL29220712 | 0.69 | HTR3E (0.55) | NPC1RAB9AMAPK1ALDH1A1 |
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-108689942-B | Nitrogen-containing bicyclic compound, and preparation method and application thereof | 广东东阳光药业有限公司 | 2023-06-09 | — | — | CN | disclosed |