Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 1/20 | 0.53 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.53 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.53 |
| ▸ | SCD5 | Q86SK9 | 7/20 | 0.50 |
| ▸ | SCD | O00767 | 4/20 | 0.50 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.48 |
| ▸ | CCNC | P24863 | 1/20 | 0.48 |
| ▸ | CDK8 | P49336 | 1/20 | 0.48 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.47 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.47 |
| ▸ | PRMT5 | O14744 | 2/20 | 0.45 |
| ▸ | WDR77 | Q9BQA1 | 2/20 | 0.45 |
| ▸ | TACR1 | P25103 | 1/20 | 0.45 |
| ▸ | TRPC3 | Q13507 | 1/20 | 0.44 |
| ▸ | TRPC6 | Q9Y210 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL166963 | 0.91 | RIPK1 (0.54) | RIPK1HSP90AA1HSP90AB1SCD5SCD | |
| SCHEMBL168416 | 0.87 | RIPK1 (0.53) | RIPK1HSP90AA1HSP90AB1SCD5SCD | |
| SCHEMBL256561 | 0.82 | HSP90AA1 (0.46) | RIPK1HSP90AA1HSP90AB1SCD5SCD | |
| SCHEMBL10140476 | 0.82 | NPC1 (0.57) | — | |
| SCHEMBL164387 | 0.79 | PARP14 (0.60) | RIPK1HSP90AA1HSP90AB1SCD5SCD | |
| SCHEMBL18143043 | 0.79 | ROCK2 (0.57) | RIPK1HSP90AA1HSP90AB1SCD5SCD | |
| SCHEMBL6266657 | 0.78 | TACR1 (0.47) | RIPK1HSP90AA1HSP90AB1SCD5SCD | |
| SCHEMBL8596155 | 0.77 | PARP14 (0.62) | RIPK1HSP90AA1HSP90AB1SCD5SCD | |
| SCHEMBL31453129 | 0.77 | SCD5 (0.58) | RIPK1HSP90AA1HSP90AB1SCD5SCD | |
| SCHEMBL166794 | 0.77 | ROCK2 (0.60) | RIPK1HSP90AA1HSP90AB1SCD5SCD |
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-2012028563-A1 | BACE INHIBITORS FOR USE IN THE TREATMENT OF DIABETES | F. HOFFMANN-LA ROCHE AG (CH) | 2012-03-08 | — | — | WO | disclosed |