Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL238032 | 0.68 | POLB (0.40) | ALDH1A1MEN1KMT2APOLBGAA | |
| SCHEMBL26551436 | 0.59 | POLB (0.96) | ALDH1A1MEN1KMT2APOLBGAA | |
| SCHEMBL6852792 | 0.59 | POLB (0.68) | ALDH1A1MEN1KMT2APOLBGAA | |
| SCHEMBL28848463 | 0.58 | GAA (0.44) | ALDH1A1MEN1KMT2APOLBGAA | |
| SCHEMBL14295929 | 0.57 | POLB (0.66) | ALDH1A1MEN1KMT2APOLBGAA | |
| Thymoquinol Dimethylether SCHEMBL12613923 | 0.57 | POLB (0.66) | ALDH1A1MEN1KMT2APOLBGAA | |
| SCHEMBL10953005 | 0.57 | POLB (0.51) | ALDH1A1MEN1KMT2APOLBGAA | |
| SCHEMBL14036622 | 0.57 | POLB (0.65) | ALDH1A1MEN1KMT2APOLBGAA | |
| SCHEMBL10956114 | 0.56 | POLB (0.54) | ALDH1A1MEN1KMT2APOLBGAA | |
| SCHEMBL14036625 | 0.56 | GAA (0.46) | ALDH1A1MEN1KMT2APOLBGAA |
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-2010098487-A1 | NITROGEN-CONTAINING FUSED HETEROCYCLIC COMPOUNDS AND THEIR USE AS BETA AMYLOID PRODUCTION INHIBITORS | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2010-09-02 | — | — | WO | disclosed |