Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 20/20 | 0.60 |
| ▸ | BACE2 | Q9Y5Z0 | 11/20 | 0.60 |
| ▸ | CTSD | P07339 | 10/20 | 0.60 |
| ▸ | CTSB | P07858 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL13306832 | 0.92 | BACE1 (0.68) | BACE1BACE2CTSDCTSB | |
| SCHEMBL3351108 | 0.92 | BACE1 (0.68) | BACE1BACE2CTSDCTSB | |
| SCHEMBL3351111 | 0.92 | BACE1 (0.68) | BACE1BACE2CTSDCTSB | |
| SCHEMBL18740514 | 0.92 | BACE1 (0.59) | BACE1BACE2CTSDCTSB | |
| SCHEMBL18740470 | 0.91 | BACE1 (0.57) | BACE1BACE2CTSDCTSB | |
| SCHEMBL18740509 | 0.86 | BACE1 (0.68) | BACE1BACE2CTSD | |
| SCHEMBL18767148 | 0.86 | BACE1 (0.78) | BACE1BACE2CTSD | |
| SCHEMBL18740491 | 0.85 | BACE1 (0.60) | BACE1BACE2CTSDCTSB | |
| SCHEMBL3353685 | 0.85 | BACE1 (0.69) | BACE1BACE2CTSDCTSB | |
| SCHEMBL3353677 | 0.85 | BACE1 (0.69) | BACE1BACE2CTSDCTSB |
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-2017066742-A1 | BACE-2 INHIBITORY COMPOUNDS AND RELATED METHODS OF USE | JORTAN PHARMACEUTICALS INC. (US) | 2017-04-20 | — | — | WO | disclosed |