Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22193935 | 0.86 | — | — | |
| SCHEMBL1644239 | 0.76 | GRIN2D (0.42) | — | |
| Hydrochloric Acid SCHEMBL1642487 | 0.73 | GRIN2D (0.40) | — | |
| SCHEMBL22193933 | 0.68 | MEN1 (0.39) | ALDH1A1 | |
| SCHEMBL11668171 | 0.65 | ALDH1A1 (0.49) | ALDH1A1 | |
| SCHEMBL20189848 | 0.65 | — | — | |
| SCHEMBL822318 | 0.64 | GRIN1 (0.57) | ALDH1A1 | |
| SCHEMBL21618340 | 0.64 | GRIN2D (0.38) | — | |
| SCHEMBL5399740 | 0.64 | GRIN2D (0.38) | — | |
| SCHEMBL12371105 | 0.63 | MEN1 (0.50) | — |
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-2020216240-A1 | DICYCLIC ALKANE COMPOUND USEFUL AS INHIBITOR OF PLASMA KALLIKREIN | 南京明德新药研发有限公司 | 2020-10-29 | — | — | WO | disclosed |