Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 8/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | PNP | P00491 | 2/20 | 0.36 |
| ▸ | QTRT1 | Q9BXR0 | 1/20 | 0.35 |
| ▸ | NOS3 | P29474 | 2/20 | 0.35 |
| ▸ | NOS2 | P35228 | 2/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9956185 | 0.69 | TYMS (0.41) | PNP | |
| SCHEMBL676634 | 0.69 | KDM4E (0.43) | NOS1KDM4ELMNAHSD17B10PNP | |
| Hydrochloric Acid SCHEMBL9545316 | 0.66 | XDH (0.33) | NOS1KDM4EHSD17B10PNPQTRT1 | |
| SCHEMBL9793234 | 0.64 | PLAUR (0.37) | KDM4EALDH1A1PMP22HSD17B10 | |
| SCHEMBL3454164 | 0.63 | NOS1 (0.53) | NOS1KDM4EALDH1A1LMNAGLA | |
| SCHEMBL9544092 | 0.63 | TYMS (0.34) | NOS1QTRT1 | |
| SCHEMBL9544423 | 0.63 | HSD17B10 (0.33) | KDM4EHSD17B10PNPQTRT1 | |
| SCHEMBL9545341 | 0.61 | PNP (0.35) | NOS1PNPQTRT1 | |
| SCHEMBL17556623 | 0.60 | NOS1 (0.49) | NOS1KDM4EALDH1A1LMNAGLA | |
| SCHEMBL3454196 | 0.59 | NOS1 (0.41) | NOS1KDM4EALDH1A1LMNAGLA |
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-2012085166-A1 | METABOTROPIC GLUTAMATE RECEPTOR MODULATORS | MERZ PHARMA GMBH & CO. KGAA (DE) | 2012-06-28 | — | — | WO | disclosed |