Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | SLC6A9 | P48067 | 13/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3848872 | 0.82 | SLC6A9 (0.61) | ALDH1A1LMNASLC6A9CYP1A2 | |
| SCHEMBL3848000 | 0.81 | ALDH1A1 (0.53) | ALDH1A1LMNASLC6A9CYP1A2GLA | |
| SCHEMBL3848851 | 0.76 | SLC6A9 (0.71) | ALDH1A1LMNASLC6A9CYP1A2 | |
| SCHEMBL4547019 | 0.75 | ALDH1A1 (0.61) | ALDH1A1LMNASLC6A9CYP1A2GAA | |
| SCHEMBL5504640 | 0.70 | ALDH1A1 (0.46) | ALDH1A1LMNASLC6A9CYP1A2GLA | |
| SCHEMBL14417825 | 0.67 | L3MBTL1 (0.44) | ALDH1A1LMNASLC6A9GAAPKM | |
| SCHEMBL24680905 | 0.66 | GAA (0.45) | ALDH1A1LMNAGAAGLA | |
| SCHEMBL23555007 | 0.66 | L3MBTL1 (0.56) | ALDH1A1LMNACYP1A2GAAPKM | |
| SCHEMBL12334763 | 0.66 | GAA (0.52) | ALDH1A1LMNAGAA | |
| SCHEMBL7297373 | 0.66 | ALDH1A1 (0.50) | ALDH1A1LMNACYP1A2 |
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-2005107469-A2 | MORPHOLINYL PIPERIDINE GLYCINE TRANSPORTER INHIBITORS | MERCK & CO., INC. (US) | 2005-11-17 | — | — | WO | disclosed |