Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 12/20 | 0.49 |
| ▸ | GRIN1 | Q05586 | 9/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.37 |
| ▸ | KDM1A | O60341 | 3/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.37 |
| ▸ | RXRA | P19793 | 5/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28825521 | 0.87 | GRIN2B (0.51) | GRIN2BGRIN1RXRAKDM4ENPC1 | |
| SCHEMBL28825439 | 0.86 | GRIN2B (0.47) | GRIN2BGRIN1KCNH2KDM1AHDAC1 | |
| SCHEMBL28825506 | 0.83 | GRIN2B (0.48) | GRIN2BGRIN1KCNH2KDM1AHDAC1 | |
| SCHEMBL28825450 | 0.81 | GRIN2B (0.49) | GRIN2BGRIN1KCNH2KDM1AHDAC1 | |
| SCHEMBL28825641 | 0.78 | GRIN1 (0.50) | GRIN2BGRIN1KCNH2KDM1AHDAC1 | |
| SCHEMBL28825553 | 0.78 | KCNH2 (0.57) | GRIN2BGRIN1KCNH2 | |
| SCHEMBL28825600 | 0.78 | GRIN2B (0.47) | GRIN2BGRIN1KCNH2KDM1AHDAC1 | |
| SCHEMBL28825453 | 0.77 | GRIN2B (0.50) | GRIN2BGRIN1KCNH2KDM1AHDAC1 | |
| SCHEMBL28825659 | 0.76 | GRIN2B (0.45) | GRIN2BGRIN1KCNH2KDM1AHDAC1 | |
| SCHEMBL28825502 | 0.74 | MAPT (0.46) | GRIN2BGRIN1KCNH2KDM1AHDAC1 |
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 |