Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.51 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.51 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.45 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.45 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.45 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.45 |
| ▸ | EGFR | P00533 | 1/20 | 0.44 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.43 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.43 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.43 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | CLCN2 | P51788 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6255108 | 0.86 | SLC6A3 (0.55) | SLC6A3SLC6A4GABRA1GABRG2GABRB3 | |
| SCHEMBL29109366 | 0.83 | SLC6A3 (0.64) | SLC6A3SLC6A4GABRA1GABRG2GABRB3 | |
| SCHEMBL27605792 | 0.80 | PDCD1 (0.53) | SLC6A3SLC6A4GABRA1GABRG2GABRB3 | |
| SCHEMBL29109368 | 0.80 | SLC6A3 (0.62) | SLC6A3SLC6A4GABRA1GABRG2GABRB3 | |
| SCHEMBL31345282 | 0.80 | SLC6A3 (0.62) | SLC6A3SLC6A4GABRA1GABRG2GABRB3 | |
| SCHEMBL28548807 | 0.78 | SLC6A3 (0.48) | SLC6A3SLC6A4GABRA1GABRG2GABRB3 | |
| SCHEMBL29416802 | 0.78 | HTT (0.54) | SLC6A3SLC6A4GABRA1GABRG2GABRB3 | |
| SCHEMBL28543311 | 0.77 | SLC6A3 (0.44) | SLC6A3SLC6A4GABRA1GABRG2GABRB3 | |
| SCHEMBL19810438 | 0.77 | ABL1 (0.46) | SLC6A3SLC6A4PDK2HTTKMT2A | |
| SCHEMBL8779255 | 0.76 | SLC6A3 (0.51) | SLC6A3SLC6A4GABRA1GABRG2GABRB3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112689630-A | Novel LXR modulators with bicyclic core moieties | 菲尼克斯-FXR股份有限公司 | 2021-04-20 | — | — | CN | disclosed |