Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 6/20 | 0.44 |
| ▸ | GRIN2B | Q13224 | 6/20 | 0.44 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | KDM1A | O60341 | 3/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28825461 | 0.89 | CYP11B1 (0.51) | GRIN1GRIN2BCYP11B1CYP11B2MAPT | |
| SCHEMBL28825580 | 0.85 | GRIN1 (0.43) | GRIN1GRIN2BCYP11B1CYP11B2MAPT | |
| SCHEMBL28825694 | 0.82 | GRIN1 (0.42) | GRIN1GRIN2BCYP11B1CYP11B2MAPT | |
| SCHEMBL28964551 | 0.81 | KDM4E (0.55) | GRIN1GRIN2BCYP11B1CYP11B2MAPT | |
| SCHEMBL28825571 | 0.73 | CYP11B1 (0.45) | GRIN1GRIN2BCYP11B1CYP11B2MAPT | |
| SCHEMBL28825453 | 0.70 | GRIN2B (0.50) | GRIN1GRIN2BCYP11B1CYP11B2MAPT | |
| SCHEMBL25378654 | 0.69 | KDM4E (0.46) | CYP11B1CYP11B2MAPTSMN1; SMN2KDM1A | |
| SCHEMBL30510028 | 0.69 | KDM4E (0.46) | CYP11B1CYP11B2MAPTSMN1; SMN2KDM1A | |
| SCHEMBL28825447 | 0.68 | GRIN2B (0.50) | GRIN1GRIN2BCYP11B1CYP11B2MAPT | |
| SCHEMBL30502865 | 0.67 | MPO (0.47) | MAPTSMN1; SMN2KDM1AHDAC1KDM4E |
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 1 patent. 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 | disclosed |