Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 5/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | FLT1 | P17948 | 1/20 | 0.46 |
| ▸ | FLT4 | P35916 | 1/20 | 0.46 |
| ▸ | KDR | P35968 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | CES2 | O00748 | 1/20 | 0.46 |
| ▸ | CES1 | P23141 | 1/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.46 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.46 |
| ▸ | GPR132 | Q9UNW8 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28908852 | 0.95 | POLB (0.53) | POLBPTGS2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL28250190 | 0.90 | POLB (0.54) | POLBNPC1RAB9ASMN1; SMN2GPR132 | |
| SCHEMBL28531213 | 0.88 | NPC1 (0.50) | POLBNPC1RAB9AGPR132CYP2C19 | |
| SCHEMBL28536704 | 0.85 | CTDSP1 (0.53) | POLBNPC1RAB9ASMN1; SMN2GPR132 | |
| SCHEMBL28250847 | 0.85 | NPC1 (0.53) | POLBPTGS2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL28250047 | 0.84 | NPC1 (0.57) | POLBNPC1RAB9ASMN1; SMN2CES2 | |
| SCHEMBL8907571 | 0.82 | MAPT (0.49) | NPC1RAB9ASMN1; SMN2GPR132ALDH1A1 | |
| SCHEMBL28546278 | 0.81 | GPR132 (0.46) | POLBNPC1RAB9ASMN1; SMN2L3MBTL1 | |
| SCHEMBL28531313 | 0.81 | POLB (0.49) | POLBNPC1RAB9ASMN1; SMN2L3MBTL1 | |
| SCHEMBL28250048 | 0.79 | RAB9A (0.51) | NPC1RAB9ACES2CES1GPR132 |
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-108752232-B | Synthetic method of alpha-quaternary carbon amino acid | 四川大学 | 2021-03-19 | — | — | CN | disclosed |