Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 10/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 10/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.35 |
| ▸ | RELA | Q04206 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | APP | P05067 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | RXRA | P19793 | 5/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28825582 | 0.83 | GRIN1 (0.44) | GRIN1GRIN2BKDM4ENPC1MAPT | |
| SCHEMBL28825578 | 0.81 | GRIN1 (0.41) | GRIN1GRIN2BAPPRXRA | |
| SCHEMBL28825599 | 0.78 | GRIN1 (0.46) | GRIN1GRIN2BNPC1RAB9AMEN1 | |
| SCHEMBL28825611 | 0.75 | GRIN1 (0.43) | GRIN1GRIN2BRXRA | |
| SCHEMBL28825471 | 0.74 | GRIN1 (0.38) | GRIN1GRIN2B | |
| SCHEMBL28825503 | 0.70 | MEN1 (0.41) | GRIN1GRIN2BNPC1RAB9AMEN1 | |
| SCHEMBL28825500 | 0.69 | RAB9A (0.40) | GRIN1GRIN2BRAB9AKMT2A | |
| SCHEMBL28825574 | 0.67 | GRIN1 (0.37) | GRIN1GRIN2B | |
| SCHEMBL20447052 | 0.67 | AAK1 (0.56) | GRIN1GRIN2BRXRA | |
| SCHEMBL18143912 | 0.66 | NFE2L2 (0.58) | KDM4ERELA |
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 |
|---|---|---|---|---|---|---|---|
| CN-114007610-A | Substituted heteroaromatic pyrazolopyridines and their use as modulators of the GLUN2B receptor | 詹森药业有限公司 | 2022-02-01 | — | — | CN | disclosed |