Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 2/20 | 0.42 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 5/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.38 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | JUN | P05412 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL28825475 | 0.83 | CYP1A1 (0.52) | NTSR1CYP11B2CYP11B1ALDH1A1CYP19A1 | |
| SCHEMBL28825574 | 0.82 | GRIN1 (0.37) | CYP11B2CYP11B1CYP19A1GRIN1GRIN2B | |
| SCHEMBL28825624 | 0.80 | GRIN2B (0.39) | CYP11B2CYP11B1GRIN1GRIN2BNFE2L2 | |
| SCHEMBL28825512 | 0.80 | GRIN1 (0.42) | NTSR1CYP11B2CYP11B1ALDH1A1NPC1 | |
| SCHEMBL28517024 | 0.79 | ALOX5 (0.50) | ALOX5NTSR1CYP11B2CYP11B1ALDH1A1 | |
| SCHEMBL28686608 | 0.79 | GRIN2B (0.37) | GRIN1GRIN2BNFE2L2 | |
| SCHEMBL28825500 | 0.77 | RAB9A (0.40) | RAB9ACYP1A1CYP1A2CYP1B1GRIN1 | |
| SCHEMBL8911420 | 0.75 | ALDH1A1 (0.62) | ALOX5CYP11B2CYP11B1ALDH1A1CYP19A1 | |
| SCHEMBL28825460 | 0.75 | ALOX5 (0.46) | ALOX5NTSR1CYP11B2CYP11B1ALDH1A1 | |
| SCHEMBL3758346 | 0.74 | RAB9A (0.49) | CYP11B2CYP11B1ALDH1A1CYP19A1NPC1 |
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 |