Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGDS | O60760 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.36 |
| ▸ | TDO2 | P48775 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | CDK7 | P50613 | 1/20 | 0.33 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.33 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.33 |
| ▸ | PI4KA | P42356 | 1/20 | 0.33 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.33 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30117332 | 1.00 | HPGDS (0.50) | HPGDSNPC1PKMRAB9ACHRNB2 | |
| Dihydronicotyrine SCHEMBL1207625 | 0.74 | CYP2A6 (0.52) | CHRNB2CHRNA3CHRNA4 | |
| SCHEMBL676678 | 0.71 | HPGDS (0.56) | HPGDSNPC1PKMRAB9ACHRNB2 | |
| SCHEMBL18652530 | 0.70 | HPGDS (0.49) | HPGDSNPC1PKMRAB9ACHRNB2 | |
| SCHEMBL17051516 | 0.69 | HPGDS (0.54) | HPGDSNPC1PKMRAB9ACHRNB2 | |
| SCHEMBL20836837 | 0.68 | NISCH (0.62) | — | |
| SCHEMBL31225112 | 0.67 | OPRM1 (0.32) | — | |
| SCHEMBL12490020 | 0.67 | HPGDS (1.00) | HPGDSNPC1RAB9A | |
| SCHEMBL1610501 | 0.66 | HPGDS (0.47) | HPGDSNPC1PKMRAB9ACHRNB2 | |
| SCHEMBL23411321 | 0.66 | HTR2C (0.54) | CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115611857-B | Preparation method of 2-methyl-5- (1-methylpyrrolidine-2-yl) pyridine | 上海伍夫科技有限公司 | 2024-05-31 | — | — | CN | claimed |
| CN-115611857-A | Preparation method of 2-methyl-5- (1-methylpyrrolidine-2-yl) pyridine | 上海伍夫科技有限公司 | 2023-01-17 | — | — | CN | claimed |
| CN-115611857-B | Preparation method of 2-methyl-5- (1-methylpyrrolidine-2-yl) pyridine | 上海伍夫科技有限公司 | 2024-05-31 | — | — | CN | disclosed |
| CN-115611857-A | Preparation method of 2-methyl-5- (1-methylpyrrolidine-2-yl) pyridine | 上海伍夫科技有限公司 | 2023-01-17 | — | — | CN | disclosed |