Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.55 |
| ▸ | NPC1 | O15118 | 2/20 | 0.55 |
| ▸ | RAB9A | P51151 | 2/20 | 0.55 |
| ▸ | PREP | P48147 | 2/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | HTR2C | P28335 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL27462940 | 1.00 | SMN1; SMN2 (0.55) | SMN1; SMN2NPC1RAB9APREPCYP2C19 | |
| SCHEMBL2768429 | 0.92 | PREP (0.60) | SMN1; SMN2NPC1RAB9APREPCYP2C19 | |
| SCHEMBL11560321 | 0.91 | FKBP1A (0.57) | SMN1; SMN2NPC1RAB9APREPCYP2C19 | |
| SCHEMBL31551949 | 0.87 | NPSR1 (0.59) | SMN1; SMN2NPC1RAB9APREPCYP2C19 | |
| SCHEMBL31552341 | 0.83 | NPSR1 (0.56) | SMN1; SMN2NPC1RAB9APREPCYP2C19 | |
| SCHEMBL25841627 | 0.82 | HTR2C (0.59) | SMN1; SMN2NPC1RAB9APREPCYP2C19 | |
| SCHEMBL28411733 | 0.82 | HTR2C (0.59) | SMN1; SMN2NPC1RAB9APREPCYP2C19 | |
| SCHEMBL31136953 | 0.82 | SMN1; SMN2 (0.51) | SMN1; SMN2NPC1RAB9APREPCYP2C19 | |
| SCHEMBL23485195 | 0.81 | SMN1; SMN2 (0.53) | SMN1; SMN2NPC1RAB9APREPCYP2C19 | |
| SCHEMBL821085 | 0.81 | SMN1; SMN2 (0.50) | SMN1; SMN2NPC1RAB9APREPCYP2C19 |
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-1125064-C | 3-pyridyl enantiomers and their use as analgesics | ABBOTT LAB (US) | 2003-10-22 | — | — | CN | disclosed |
| CN-1245496-A | 3-pyridyl enantiomers and their use as analgesics | ABBOTT LAB (US) | 2000-02-23 | — | — | CN | disclosed |