Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 1/20 | 0.37 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.37 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.30 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL933050 | 0.90 | HCRTR1 (0.37) | HCRTR1HCRTR2AAK1BRD4CREBBP | |
| SCHEMBL932334 | 0.90 | HCRTR1 (0.37) | HCRTR1HCRTR2AAK1BRD4CREBBP | |
| SCHEMBL933387 | 0.86 | USP2 (0.34) | — | |
| SCHEMBL932583 | 0.82 | BACE1 (0.44) | — | |
| SCHEMBL932766 | 0.79 | HCRTR1 (0.37) | HCRTR1HCRTR2AAK1 | |
| SCHEMBL6874988 | 0.79 | HCRTR1 (0.37) | HCRTR1HCRTR2AAK1 | |
| SCHEMBL8028509 | 0.77 | HCRTR1 (0.38) | HCRTR1HCRTR2AAK1 | |
| SCHEMBL2620087 | 0.77 | HCRTR1 (0.38) | HCRTR1HCRTR2AAK1 | |
| SCHEMBL932781 | 0.77 | BACE1 (0.32) | AAK1 | |
| SCHEMBL933505 | 0.73 | CYP1A2 (0.36) | HCRTR1HCRTR2 |
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-2011005738-A1 | BACE INHIBITORS | ELI LILLY AND COMPANY (US) | 2011-01-13 | — | — | WO | disclosed |