Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 4/20 | 0.40 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.39 |
| ▸ | AURKA | O14965 | 1/20 | 0.36 |
| ▸ | ADCY10 | Q96PN6 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28825573 | 0.83 | GRIN2B (0.41) | GRIN2BGRIN1PDE4BMAPTGAA | |
| SCHEMBL28825445 | 0.68 | GRIN2B (0.51) | GRIN2BGRIN1KCNH2CYP1A2CYP2C9 | |
| SCHEMBL28825559 | 0.67 | PDE4B (0.48) | GRIN2BGRIN1PDE4BMAPTGAA | |
| SCHEMBL28851379 | 0.66 | GAA (0.46) | PDE4BMAPTGAABRD4CYP2C9 | |
| SCHEMBL28825510 | 0.66 | GRIN2B (0.52) | GRIN2BGRIN1MAPTGAAKCNH2 | |
| SCHEMBL28949569 | 0.65 | GRIN2B (0.38) | GRIN2BGRIN1MAPTGAAKCNH2 | |
| SCHEMBL28825487 | 0.65 | GRIN2B (0.51) | GRIN2BGRIN1MAPTGAAKCNH2 | |
| SCHEMBL28825565 | 0.65 | GRIN2B (0.43) | GRIN2BGRIN1MAPTGAABRD4 | |
| SCHEMBL28825588 | 0.65 | GAA (0.50) | GRIN2BGRIN1PDE4BMAPTGAA | |
| SCHEMBL30961435 | 0.65 | GAA (0.49) | PDE4BMAPTGAAAURKAADCY10 |
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 |