Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 13/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | GRIN1 | Q05586 | 8/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.41 |
| ▸ | KLKB1 | P03952 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28825510 | 0.94 | GRIN2B (0.52) | GRIN2BGAAMAPTGRIN1KCNH2 | |
| SCHEMBL28825653 | 0.93 | GAA (0.44) | GRIN2BGAAMAPTGRIN1KLKB1 | |
| SCHEMBL28825554 | 0.89 | KCNH2 (0.45) | GRIN2BGAAMAPTGRIN1KCNH2 | |
| SCHEMBL28825499 | 0.87 | KCNH2 (0.47) | GRIN2BGAAMAPTGRIN1KCNH2 | |
| SCHEMBL28825492 | 0.85 | KCNH2 (0.48) | GRIN2BGRIN1KCNH2 | |
| SCHEMBL28825448 | 0.84 | GAA (0.47) | GRIN2BGAAMAPTGRIN1KLKB1 | |
| SCHEMBL28949597 | 0.81 | GAA (0.42) | GRIN2BGAAMAPTGRIN1KLKB1 | |
| SCHEMBL28825588 | 0.81 | GAA (0.50) | GRIN2BGAAMAPTGRIN1KCNH2 | |
| SCHEMBL28825562 | 0.81 | GAA (0.52) | GRIN2BGAAMAPTGRIN1KLKB1 | |
| SCHEMBL28931688 | 0.80 | KCNH2 (0.45) | GRIN2BGAAMAPTGRIN1KCNH2 |
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 |