Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 1/20 | 0.49 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CCR1 | P32246 | 3/20 | 0.41 |
| ▸ | AKT2 | P31751 | 3/20 | 0.41 |
| ▸ | GSK3B | P49841 | 3/20 | 0.41 |
| ▸ | GRM5 | P41594 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.38 |
| ▸ | FNTA | P49354 | 1/20 | 0.38 |
| ▸ | FNTB | P49356 | 1/20 | 0.38 |
| ▸ | RORC | P51449 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1003431 | 0.81 | MEN1 (0.52) | SLC6A4SLC6A3DRD2 | |
| SCHEMBL3932199 | 0.81 | SLC6A4 (0.57) | SLC6A4SLC6A3AKT2GSK3BHSD11B1 | |
| SCHEMBL12346684 | 0.76 | SLC6A3 (0.58) | SLC6A4SLC6A3AKT2GSK3B | |
| SCHEMBL28831246 | 0.76 | SLC6A4 (0.48) | SLC6A4SLC6A3AKT2GSK3BDRD2 | |
| SCHEMBL5166600 | 0.74 | SLC6A4 (0.64) | SLC6A4SLC6A3AKT2GSK3BP2RX7 | |
| SCHEMBL14386231 | 0.73 | ALDH1A1 (0.47) | CYP3A4HSD11B1SLC2A1 | |
| SCHEMBL4450653 | 0.73 | CCR1 (0.66) | CCR1 | |
| SCHEMBL14510701 | 0.72 | SLC6A3 (0.60) | SLC6A4SLC6A3AKT2GSK3B | |
| SCHEMBL1672926 | 0.72 | SLC6A3 (0.81) | SLC6A4SLC6A3 | |
| SCHEMBL27774587 | 0.71 | SLC6A4 (0.55) | SLC6A4SLC6A3AKT2GSK3BDRD2 |
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-2007125321-A2 | PURINE AND DEAZAPURINE DERIVATIVES AS PHARMACEUTICAL COMPOUNDS | ASTEX THERAPEUTICS LIMITED (GB) | 2007-11-08 | — | — | WO | disclosed |