Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 5/20 | 0.36 |
| ▸ | CA1 | P00915 | 3/20 | 0.36 |
| ▸ | CA9 | Q16790 | 2/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4127363 | 0.81 | — | — | |
| SCHEMBL31071491 | 0.77 | — | — | |
| SCHEMBL276235 | 0.77 | TSHR (0.32) | CA2CA1CA7 | |
| SCHEMBL3873895 | 0.75 | — | — | |
| SCHEMBL7334215 | 0.75 | — | — | |
| SCHEMBL8638153 | 0.70 | CA1 (0.31) | CA2CA1CA9CA7 | |
| SCHEMBL23670889 | 0.70 | CA2 (0.32) | CA2CA1CA9CA7CA13 | |
| SCHEMBL23670047 | 0.70 | CA2 (0.32) | CA2CA1CA9CA7CA13 | |
| SCHEMBL19285113 | 0.70 | CA2 (0.32) | CA2CA1CA9CA7CA13 | |
| SCHEMBL9118932 | 0.67 | CA1 (0.33) | CA2CA1CA9CA7CA13 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2488031-A1 | DIARYL ETHER DERIVATIVES AS NOTCH SPARING GAMMA SECRETASE INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2012-08-22 | — | — | EP | disclosed |
| WO-2011046774-A1 | DIARYL ETHER DERIVATIVES AS NOTCH SPARING GAMMA SECRETASE INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2011-04-21 | — | — | WO | disclosed |