Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 17/20 | 0.49 |
| ▸ | CTSD | P07339 | 14/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14617646 | 1.00 | BACE1 (0.49) | BACE1CTSDALDH1A1TSHRGRM5 | |
| SCHEMBL7541601 | 1.00 | BACE1 (0.49) | BACE1CTSDALDH1A1TSHRGRM5 | |
| SCHEMBL12173843 | 0.95 | BACE1 (0.51) | BACE1CTSDALDH1A1TSHR | |
| SCHEMBL13054144 | 0.95 | BACE1 (0.51) | BACE1CTSDALDH1A1TSHR | |
| SCHEMBL12174286 | 0.95 | BACE1 (0.51) | BACE1CTSDALDH1A1TSHR | |
| SCHEMBL2962292 | 0.95 | BACE1 (0.51) | BACE1CTSDALDH1A1TSHR | |
| SCHEMBL8197967 | 0.95 | BACE1 (0.51) | BACE1CTSDALDH1A1TSHR | |
| SCHEMBL7554360 | 0.95 | BACE1 (0.51) | BACE1CTSDALDH1A1TSHR | |
| SCHEMBL13441120 | 0.91 | BACE1 (0.48) | BACE1CTSDALDH1A1TSHR | |
| SCHEMBL7599848 | 0.91 | BACE1 (0.48) | BACE1CTSDALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-7700603-B2 | Heterocyclic aspartyl protease inhibitors | SCHERING CORPORATION (US) | 2010-04-20 | — | — | US | disclosed |