Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 14/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.37 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.36 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.34 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.34 |
| ▸ | BRS3 | P32247 | 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 | |
|---|---|---|---|---|
| SCHEMBL28456730 | 0.82 | NOTUM (0.50) | NOTUMKEAP1 | |
| SCHEMBL2028396 | 0.75 | ADH5 (0.32) | — | |
| SCHEMBL10447781 | 0.75 | NOTUM (0.78) | NOTUMCYP19A1KEAP1BRS3 | |
| SCHEMBL13411813 | 0.73 | ADH5 (0.36) | — | |
| SCHEMBL13407536 | 0.73 | NOTUM (0.36) | NOTUMKEAP1 | |
| SCHEMBL28340369 | 0.72 | ADH5 (0.55) | NOTUM | |
| SCHEMBL6355265 | 0.71 | NOTUM (0.37) | NOTUMCYP19A1KEAP1 | |
| SCHEMBL26156419 | 0.71 | NOTUM (0.60) | NOTUMCYP19A1KEAP1KDM5B | |
| SCHEMBL11053038 | 0.70 | NOTUM (0.62) | NOTUM | |
| SCHEMBL16321273 | 0.69 | NOTUM (0.58) | NOTUMCYP19A1KEAP1KDM5BMAPK8 |
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-110358102-B | Polyacid-based metal organic framework crystal material, preparation method and application of polyacid-based metal organic framework crystal material in catalytic synthesis of hydroquinone compounds | 大连理工大学 | 2021-04-20 | — | — | CN | claimed |
| CN-110358102-B | Polyacid-based metal organic framework crystal material, preparation method and application of polyacid-based metal organic framework crystal material in catalytic synthesis of hydroquinone compounds | 大连理工大学 | 2021-04-20 | — | — | CN | disclosed |