Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 3/20 | 0.38 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.38 |
| ▸ | HCRTR1 | O43613 | 8/20 | 0.37 |
| ▸ | HCRTR2 | O43614 | 8/20 | 0.37 |
| ▸ | CCR3 | P51677 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | TRPV1 | Q8NER1 | 4/20 | 0.35 |
| ▸ | GRM5 | P41594 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2726370 | 1.00 | BACE1 (0.38) | BACE1BACE2HCRTR1HCRTR2CCR3 | |
| SCHEMBL2726366 | 1.00 | BACE1 (0.38) | BACE1BACE2HCRTR1HCRTR2CCR3 | |
| SCHEMBL2725689 | 0.93 | BACE1 (0.40) | BACE1BACE2HCRTR1HCRTR2 | |
| SCHEMBL6465777 | 0.93 | BACE1 (0.40) | BACE1BACE2HCRTR1HCRTR2 | |
| SCHEMBL2725213 | 0.93 | BACE1 (0.40) | BACE1BACE2HCRTR1HCRTR2 | |
| SCHEMBL2725209 | 0.93 | BACE1 (0.40) | BACE1BACE2HCRTR1HCRTR2 | |
| SCHEMBL2725211 | 0.93 | BACE1 (0.40) | BACE1BACE2HCRTR1HCRTR2 | |
| SCHEMBL2725690 | 0.93 | BACE1 (0.40) | BACE1BACE2HCRTR1HCRTR2 | |
| SCHEMBL2726835 | 0.89 | GRM5 (0.38) | BACE1BACE2TRPV1GRM5 | |
| SCHEMBL2726833 | 0.89 | GRM5 (0.38) | BACE1BACE2TRPV1GRM5 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012054510-A1 | OXADIAZOLE COMPOUNDS WHICH INHIBIT BETA-SECRETASE ACTIVITY AND METHODS OF USE THEREOF | COMENTIS, INC. (US) | 2012-04-26 | — | — | WO | claimed |
| WO-2012054510-A1 | OXADIAZOLE COMPOUNDS WHICH INHIBIT BETA-SECRETASE ACTIVITY AND METHODS OF USE THEREOF | COMENTIS, INC. (US) | 2012-04-26 | — | — | WO | disclosed |