Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | HTT | P42858 | 3/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.33 |
| ▸ | NR1H3 | Q13133 | 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 | |
|---|---|---|---|---|
| SCHEMBL20138854 | 0.83 | KDM4E (0.38) | LMNASLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL20159359 | 0.73 | BRD9 (0.41) | SLC6A4 | |
| SCHEMBL20138709 | 0.72 | ALDH1A1 (0.38) | LMNASLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL6916024 | 0.69 | KMT2A (0.41) | LMNASLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL20138857 | 0.69 | HTT (0.35) | LMNASLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL20138853 | 0.69 | HTT (0.42) | LMNASLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL20139202 | 0.67 | ALDH1A1 (0.35) | LMNASLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL20159293 | 0.66 | KMT2A (0.37) | LMNASLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL23504859 | 0.65 | HTR1A (0.36) | ALDH1A1HTTNPSR1CYP3A4CYP2C9 | |
| SCHEMBL28302477 | 0.65 | SLC6A2 (0.39) | LMNASLC6A2SLC6A4SLC6A3ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018087018-A1 | PHENOXYTRIAZOLES | F. HOFFMANN-LA ROCHE AG (CH) | 2018-05-17 | — | — | WO | disclosed |