Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | BACE1 | P56817 | 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 | |
|---|---|---|---|---|
| SCHEMBL10988515 | 0.82 | PDCD1 (0.36) | IDO1 | |
| SCHEMBL10992197 | 0.79 | BAX (0.34) | SMN1; SMN2BACE1 | |
| SCHEMBL10993826 | 0.78 | BACE1 (0.32) | BACE1 | |
| SCHEMBL7446439 | 0.76 | — | — | |
| SCHEMBL10992177 | 0.74 | SMN1; SMN2 (0.35) | IDO1SMN1; SMN2BACE1 | |
| SCHEMBL10996604 | 0.74 | SIGMAR1 (0.35) | SMN1; SMN2BACE1 | |
| SCHEMBL10991101 | 0.71 | SLC6A2 (0.37) | — | |
| SCHEMBL10992659 | 0.71 | SLC6A2 (0.37) | — | |
| SCHEMBL10989799 | 0.71 | IDO1 (0.34) | IDO1SMN1; SMN2BACE1 | |
| SCHEMBL10995194 | 0.71 | ALDH1A1 (0.44) | SMN1; SMN2BACE1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4558129-A | Benzodioxanyl-hydroxyethylene-piperazinyl acetanilides which effect calcium entry and β-blockade | SYNTEX (U.S.A.) INC. (US) | 1985-12-10 | — | — | US | disclosed |