Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 3/20 | 0.47 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.44 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.44 |
| ▸ | SMYD3 | Q9H7B4 | 3/20 | 0.43 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.40 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | NR2E3 | Q9Y5X4 | 1/20 | 0.40 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.40 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4187617 | 0.77 | GRIN1 (0.48) | GRIN1GRIN2BMEN1KMT2APPARG | |
| SCHEMBL8007245 | 0.77 | MEN1 (0.53) | GRIN1GRIN2BMEN1KMT2APPARG | |
| SCHEMBL14815695 | 0.76 | MAOB (0.53) | MAOBSMYD3KCNH2ROCK2KDM4E | |
| SCHEMBL2019165 | 0.75 | GRIN1 (0.74) | GRIN1GRIN2BMEN1KMT2AHTT | |
| SCHEMBL4255057 | 0.74 | GRIN1 (0.42) | GRIN1GRIN2BMEN1KMT2APPARG | |
| SCHEMBL14846360 | 0.72 | MAOB (0.52) | MAOBSMYD3KCNH2ROCK2 | |
| SCHEMBL2021301 | 0.71 | KCNH2 (0.52) | MAOBMEN1KMT2AHTTKCNH2 | |
| SCHEMBL13656202 | 0.71 | GRIN1 (0.49) | GRIN1GRIN2BMEN1KMT2APPARG | |
| SCHEMBL31718496 | 0.70 | ROCK2 (0.58) | MAOBMEN1KMT2ABRD4ROCK2 | |
| SCHEMBL12874455 | 0.69 | KIF11 (0.51) | GRIN1GRIN2BSMYD3TNIK |
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-2009006437-A1 | NMDA RECEPTOR ANTAGONISTS FOR NEUROPROTECTION | EMORY UNIVERSITY (US) | 2009-01-08 | — | — | WO | disclosed |