Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.50 |
| ▸ | CYP11B1 | P15538 | 7/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 7/20 | 0.37 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.30 |
| ▸ | CDK9 | P50750 | 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 | |
|---|---|---|---|---|
| SCHEMBL13466607 | 0.81 | BACE1 (0.65) | BACE1CYP11B1CYP11B2CCNT1CDK9 | |
| SCHEMBL18567381 | 0.72 | BACE1 (0.41) | BACE1 | |
| SCHEMBL18567792 | 0.69 | BACE1 (0.51) | BACE1 | |
| SCHEMBL18567394 | 0.69 | BACE1 (0.46) | BACE1 | |
| SCHEMBL18567406 | 0.69 | BACE1 (0.49) | BACE1 | |
| SCHEMBL18567822 | 0.69 | BACE1 (0.51) | BACE1 | |
| SCHEMBL18567787 | 0.69 | BACE1 (0.51) | BACE1 | |
| SCHEMBL18567273 | 0.68 | BACE1 (0.46) | BACE1 | |
| SCHEMBL18567390 | 0.66 | BACE1 (0.49) | BACE1 | |
| SCHEMBL18567809 | 0.66 | BACE1 (0.52) | BACE1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2697210-B1 | 5-SUBSTITUTED IMINOTHIAZINES AND THEIR MONO-AND DIOXIDES AS BACE INHIBITORS, COMPOSITIONS, AND THEIR USE | MERCK SHARP & DOHME (US) | 2017-03-01 | — | — | EP | disclosed |