Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.43 |
| ▸ | GRIN1 | Q05586 | 11/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 11/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.39 |
| ▸ | PRKACA | P17612 | 1/20 | 0.37 |
| ▸ | PRKACG | P22612 | 1/20 | 0.37 |
| ▸ | PRKACB | P22694 | 1/20 | 0.37 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | TEK | Q02763 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28949592 | 0.91 | KCNH2 (0.43) | KCNH2GRIN1GRIN2BGAAMAPT | |
| SCHEMBL28825499 | 0.83 | KCNH2 (0.47) | KCNH2GRIN1GRIN2BGAAMAPT | |
| SCHEMBL28825653 | 0.80 | GAA (0.44) | GRIN1GRIN2BGAAMAPTPDE4B | |
| SCHEMBL28825487 | 0.80 | GRIN2B (0.51) | KCNH2GRIN1GRIN2BGAAMAPT | |
| SCHEMBL28825554 | 0.76 | KCNH2 (0.45) | KCNH2GRIN1GRIN2BGAAMAPT | |
| SCHEMBL28825498 | 0.76 | KCNH2 (0.48) | KCNH2GRIN1GRIN2BGAAMAPT | |
| SCHEMBL28825510 | 0.74 | GRIN2B (0.52) | KCNH2GRIN1GRIN2BGAAMAPT | |
| SCHEMBL28825550 | 0.73 | GAA (0.45) | KCNH2GRIN1GRIN2BGAAMAPT | |
| SCHEMBL28825492 | 0.73 | KCNH2 (0.48) | KCNH2GRIN1GRIN2BPDE4B | |
| SCHEMBL28825448 | 0.71 | GAA (0.47) | GRIN1GRIN2BGAAMAPTPDE4B |
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 |