Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | CDK1 | P06493 | 2/20 | 0.31 |
| ▸ | MAPKAPK2 | P49137 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29898372 | 1.00 | NPC1 (0.31) | NPC1CYP1A2RAB9ACDK1MAPKAPK2 | |
| SCHEMBL30570963 | 1.00 | NPC1 (0.31) | NPC1CYP1A2RAB9ACDK1MAPKAPK2 | |
| SCHEMBL16928520 | 1.00 | NPC1 (0.31) | NPC1CYP1A2RAB9ACDK1MAPKAPK2 | |
| SCHEMBL29004251 | 0.81 | HTR2C (0.40) | NPC1RAB9A | |
| SCHEMBL29070676 | 0.81 | CHRNB2 (0.36) | CDK1MAPKAPK2 | |
| SCHEMBL29004258 | 0.81 | HTR2C (0.33) | NPC1RAB9ACDK1MAPKAPK2 | |
| SCHEMBL15508248 | 0.81 | HTR2C (0.40) | NPC1RAB9A | |
| SCHEMBL29004257 | 0.81 | HTR2C (0.33) | NPC1RAB9ACDK1MAPKAPK2 | |
| SCHEMBL29004256 | 0.81 | HTR2C (0.40) | NPC1RAB9A | |
| SCHEMBL29070741 | 0.78 | CYP1A2 (0.38) | NPC1CYP1A2RAB9A |
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-114957138-A | Quinoxaline asymmetric hydrogenation method | 哈尔滨工业大学（深圳） | 2022-08-30 | — | — | CN | disclosed |