Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 11/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 9/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 7/20 | 0.41 |
| ▸ | DHFR | P00374 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4552038 | 0.78 | SLC6A3 (0.42) | SLC6A3SLC6A2SLC6A4DHFRALDH1A1 | |
| Acetic Acid SCHEMBL29251586 | 0.77 | SLC6A3 (0.45) | SLC6A3SLC6A2SLC6A4DHFR | |
| SCHEMBL4553207 | 0.77 | SLC6A3 (0.41) | SLC6A3SLC6A2SLC6A4DHFRALDH1A1 | |
| SCHEMBL20960624 | 0.75 | SLC6A2 (0.45) | SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL14359569 | 0.75 | SLC6A2 (0.45) | SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL19622233 | 0.72 | SLC6A2 (0.43) | SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL8395460 | 0.71 | SLC6A3 (0.43) | SLC6A3SLC6A2SLC6A4DHFRALDH1A1 | |
| Acetic Acid SCHEMBL29252308 | 0.71 | SLC6A3 (0.45) | SLC6A3SLC6A2SLC6A4DHFR | |
| SCHEMBL27467455 | 0.71 | SLC6A2 (0.49) | SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL4552040 | 0.71 | SLC6A3 (0.45) | SLC6A3SLC6A2SLC6A4DHFRALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1612207-B1 | Processes and intermediates for preparing 2-substituted piperidine stereoisomers | CELGENE CORP (US) | 2009-01-07 | — | — | EP | claimed |
| EP-1612207-A1 | Processes and intermediates for preparing 2-substituted piperidine stereoisomers | CELGENE CORPORATION (US) | 2006-01-04 | — | — | EP | claimed |