Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 3/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6378590 | 0.84 | KCNH2 (0.52) | KCNH2SLC6A2SLC6A3GRIN1GRIN2B | |
| SCHEMBL6378418 | 0.82 | KCNH2 (0.62) | KCNH2SLC6A2SLC6A3GRIN1GRIN2B | |
| Hydrochloric Acid SCHEMBL6442762 | 0.82 | KCNH2 (0.61) | KCNH2SLC6A2SLC6A3GRIN1GRIN2B | |
| SCHEMBL6378942 | 0.80 | MAPT (0.43) | KCNH2SLC6A2SLC6A3 | |
| SCHEMBL4206093 | 0.77 | KCNH2 (0.71) | KCNH2SLC6A2SLC6A3 | |
| SCHEMBL4216135 | 0.77 | KCNH2 (0.71) | KCNH2SLC6A2SLC6A3 | |
| SCHEMBL6379406 | 0.73 | HSD17B10 (0.38) | KCNH2 | |
| SCHEMBL6378907 | 0.71 | KMT2A (0.43) | KCNH2SLC6A2SLC6A3 | |
| SCHEMBL13948485 | 0.70 | KCNH2 (0.59) | KCNH2SLC6A2SLC6A3 | |
| SCHEMBL3405309 | 0.68 | CYP19A1 (0.56) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1436258-A4 | PH-DEPENDENT NMDA RECEPTOR ANTAGONISTS | UNIV EMORY (US) | 2005-03-23 | — | — | EP | claimed |
| EP-1436258-A2 | PH-DEPENDENT NMDA RECEPTOR ANTAGONISTS | Emory University (US) | 2004-07-14 | — | — | EP | claimed |
| WO-2002072542-A2 | PH-DEPENDENT NMDA RECEPTOR ANTAGONISTS | EMORY UNIVERSITY (US) | 2002-09-19 | — | — | WO | claimed |
| EP-1436258-A4 | PH-DEPENDENT NMDA RECEPTOR ANTAGONISTS | UNIV EMORY (US) | 2005-03-23 | — | — | EP | disclosed |
| EP-1436258-A2 | PH-DEPENDENT NMDA RECEPTOR ANTAGONISTS | Emory University (US) | 2004-07-14 | — | — | EP | disclosed |
| WO-2002072542-A2 | PH-DEPENDENT NMDA RECEPTOR ANTAGONISTS | EMORY UNIVERSITY (US) | 2002-09-19 | — | — | WO | disclosed |