Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | FFAR1 | O14842 | 6/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | F2 | P00734 | 1/20 | 0.40 |
| ▸ | F10 | P00742 | 1/20 | 0.40 |
| ▸ | KMO | O15229 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL15533197 | 1.00 | SLC6A3 (0.47) | SLC6A3SLC6A2SLC6A4HTTALDH1A1 | |
| Hydrochloric Acid SCHEMBL6777080 | 0.99 | SLC6A3 (0.49) | SLC6A3SLC6A2SLC6A4HTTALDH1A1 | |
| SCHEMBL5720979 | 0.89 | SLC6A3 (0.40) | SLC6A3SLC6A2SLC6A4HTTALDH1A1 | |
| SCHEMBL16553024 | 0.87 | KDM4E (0.41) | SLC6A3SLC6A2SLC6A4HTTALDH1A1 | |
| SCHEMBL16553025 | 0.87 | KDM4E (0.41) | SLC6A3SLC6A2SLC6A4HTTALDH1A1 | |
| SCHEMBL16553230 | 0.87 | KDM4E (0.41) | SLC6A3SLC6A2SLC6A4HTTALDH1A1 | |
| SCHEMBL5720935 | 0.86 | L3MBTL1 (0.45) | SLC6A3SLC6A2SLC6A4HTTALDH1A1 | |
| SCHEMBL7728008 | 0.85 | SLC6A3 (0.49) | SLC6A3SLC6A2SLC6A4HTTALDH1A1 | |
| SCHEMBL8771122 | 0.85 | SLC6A3 (0.49) | SLC6A3SLC6A2SLC6A4HTTALDH1A1 | |
| SCHEMBL5862004 | 0.85 | LMNA (0.47) | SLC6A3SLC6A2SLC6A4HTTALDH1A1 |
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-2852578-A1 | SUBSTITUTED ß-AMINO ACID DERIVATIVES AS CXCR3 RECEPTOR ANTAGONISTS | SANOFI (FR) | 2015-04-01 | — | — | EP | disclosed |
| WO-2013174485-A1 | SUBSTITUTED ß-AMINO ACID DERIVATIVES AS CXCR3 RECEPTOR ANTAGONISTS | SANOFI (FR) | 2013-11-28 | — | — | WO | disclosed |