Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 5/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 9/20 | 0.38 |
| ▸ | GRIN1 | Q05586 | 5/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.34 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.34 |
| ▸ | RXRA | P19793 | 3/20 | 0.31 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.31 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.31 |
| ▸ | FEN1 | P39748 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28825465 | 0.81 | GRIN2B (0.41) | KCNH2GRIN2BGRIN1ROCK2ROCK1 | |
| SCHEMBL28825574 | 0.76 | GRIN1 (0.37) | GRIN2BGRIN1 | |
| SCHEMBL28825526 | 0.75 | GRIN2B (0.40) | KCNH2GRIN2BGRIN1RXRA | |
| SCHEMBL28686608 | 0.73 | GRIN2B (0.37) | GRIN2BGRIN1 | |
| SCHEMBL28825697 | 0.73 | NFE2L2 (0.35) | GRIN2BGRIN1 | |
| SCHEMBL19398612 | 0.72 | KCNH2 (0.55) | KCNH2GRIN2BGRIN1ROCK2ROCK1 | |
| SCHEMBL28825504 | 0.72 | ALOX5 (0.42) | GRIN2BGRIN1 | |
| SCHEMBL28825599 | 0.72 | GRIN1 (0.46) | GRIN2BGRIN1RXRA | |
| SCHEMBL28825624 | 0.71 | GRIN2B (0.39) | KCNH2GRIN2BGRIN1RXRA | |
| SCHEMBL28825640 | 0.71 | GRIN2B (0.47) | KCNH2GRIN2BGRIN1RXRA |
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 2 patents. 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 | claimed |
| 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 |