Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.31 |
| ▸ | DRD3 | P35462 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.30 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.30 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.30 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.30 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.30 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.30 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL30309446 | 1.00 | ALDH1A1 (0.32) | ALDH1A1DRD2DRD3CA1CA2 | |
| SCHEMBL23529007 | 0.71 | — | — | |
| SCHEMBL10827503 | 0.71 | DRD2 (0.33) | ALDH1A1DRD2DRD3GRIN2DGRIN3B | |
| SCHEMBL442388 | 0.71 | — | — | |
| SCHEMBL518391 | 0.70 | PLAU (0.41) | — | |
| Hydrochloric Acid SCHEMBL8823227 | 0.69 | PLAU (0.40) | — | |
| SCHEMBL7424121 | 0.67 | — | — | |
| SCHEMBL790376 | 0.67 | DRD2 (0.37) | DRD2DRD3GRIN2DGRIN3BGRIN1 | |
| SCHEMBL1047620 | 0.67 | DRD2 (0.34) | ALDH1A1DRD2DRD3GRIN2DGRIN3B | |
| SCHEMBL8348677 | 0.66 | — | — |
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-107922348-A | Bicyclic heterocyclic amide derivatives | 大日本住友制药株式会社 | 2018-04-17 | — | — | CN | disclosed |
| CN-106999479-A | It can be used as the heteroaryl compound of SUMO activating enzyme inhibitors | 米伦纽姆医药公司 | 2017-08-01 | — | — | CN | disclosed |