Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.48 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.48 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.48 |
| ▸ | BRD4 | O60885 | 1/20 | 0.47 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.46 |
| ▸ | FEN1 | P39748 | 1/20 | 0.46 |
| ▸ | GRIN2B | Q13224 | 10/20 | 0.42 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.42 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.41 |
| ▸ | GRIN1 | Q05586 | 7/20 | 0.40 |
| ▸ | ITK | Q08881 | 2/20 | 0.39 |
| ▸ | BTK | Q06187 | 1/20 | 0.39 |
| ▸ | PLK4 | O00444 | 1/20 | 0.38 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.38 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.38 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.38 |
| ▸ | JAK2 | O60674 | 1/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.38 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.38 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28516948 | 0.86 | BRD4 (0.50) | PIK3C3BRD4ALOX5APFEN1GRIN2B | |
| SCHEMBL28214572 | 0.84 | GRIN2B (0.47) | PIK3C3BRD4ALOX5APFEN1GRIN2B | |
| SCHEMBL21611133 | 0.83 | BRD4 (0.49) | PIK3C3PDGFRBPDGFRABRD4ALOX5AP | |
| SCHEMBL28215219 | 0.81 | PIK3C3 (0.48) | PIK3C3PDGFRBPDGFRABRD4ALOX5AP | |
| SCHEMBL18363125 | 0.80 | BRD4 (0.49) | PIK3C3BRD4ALOX5APFEN1GRIN2B | |
| SCHEMBL30133030 | 0.77 | PDGFRB (0.48) | PDGFRBPDGFRAGRIN2BDYRK1AGRIN1 | |
| SCHEMBL28214610 | 0.76 | ALOX5AP (0.57) | PIK3C3BRD4ALOX5APFEN1GRIN2B | |
| SCHEMBL18363124 | 0.76 | AXL (0.54) | PIK3C3PDGFRBPDGFRABRD4ALOX5AP | |
| SCHEMBL13854147 | 0.74 | RIPK1 (0.62) | PDGFRBPDGFRABRD4DYRK1AIRAK4 | |
| SCHEMBL15058364 | 0.73 | AHR (0.45) | PIK3C3BRD4ALOX5APFEN1CDK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108026094-A | Substituted 4-azaindoles and their use as modulators of the G L UN2B receptor | 詹森药业有限公司 | 2018-05-11 | — | — | CN | claimed |
| CN-108026094-B | Substituted 4-azaindoles and their use as modulators of the GLUN2B receptor | 詹森药业有限公司 | 2021-02-09 | — | — | CN | disclosed |
| CN-108026094-A | Substituted 4-azaindoles and their use as modulators of the G L UN2B receptor | 詹森药业有限公司 | 2018-05-11 | — | — | CN | disclosed |