Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP2 | O95551 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | CMA1 | P23946 | 1/20 | 0.34 |
| ▸ | AHR | P35869 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | METAP1 | P53582 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | BACE1 | P56817 | 3/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9958538 | 0.81 | TDP2 (0.46) | TDP2PARP1CMA1AHRBRD4 | |
| SCHEMBL9959281 | 0.79 | BACE1 (0.40) | TDP2PARP1CMA1AHRBRD4 | |
| SCHEMBL18065482 | 0.77 | PNMT (0.38) | TDP2CMA1AHRBRD4METAP1 | |
| SCHEMBL18065483 | 0.77 | PNMT (0.38) | TDP2CMA1AHRBRD4METAP1 | |
| SCHEMBL10249815 | 0.77 | CA1 (0.42) | TDP2PARP1CMA1AHRBRD4 | |
| SCHEMBL9948406 | 0.77 | CA1 (0.42) | TDP2PARP1CMA1AHRBRD4 | |
| SCHEMBL9947977 | 0.77 | CA1 (0.42) | TDP2PARP1CMA1AHRBRD4 | |
| SCHEMBL9958466 | 0.73 | BACE1 (0.40) | TDP2CMA1AHRMETAP1CA1 | |
| SCHEMBL31076 | 0.73 | BACE1 (0.40) | TDP2CMA1AHRMETAP1CA1 | |
| SCHEMBL9958457 | 0.73 | TDP2 (0.41) | TDP2PARP1CMA1AHRBRD4 |
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-2655378-B1 | COMPOUNDS AND THEIR USE AS BACE INHIBITORS | ASTRAZENECA AB (SE) | 2017-03-01 | — | — | EP | disclosed |