Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.43 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.43 |
| ▸ | CDK5R1 | Q15078 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | KDM5A | P29375 | 1/20 | 0.40 |
| ▸ | CPB2 | Q96IY4 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL22920208 | 0.99 | ALDH1A1 (0.45) | NOTUMALDH1A1CDK5CDK5R1TSHR | |
| SCHEMBL15236764 | 0.99 | ALDH1A1 (0.45) | NOTUMALDH1A1CDK5CDK5R1TSHR | |
| SCHEMBL12983979 | 0.97 | NOTUM (0.45) | NOTUMALDH1A1CDK5CDK5R1TSHR | |
| SCHEMBL1268993 | 0.94 | NOTUM (0.47) | NOTUMALDH1A1CDK5CDK5R1TSHR | |
| SCHEMBL14631229 | 0.89 | CPB2 (0.46) | NOTUMALDH1A1CDK5CDK5R1CYP1A2 | |
| SCHEMBL14631042 | 0.89 | CPB2 (0.46) | NOTUMALDH1A1CDK5CDK5R1CYP1A2 | |
| SCHEMBL14631044 | 0.89 | CPB2 (0.46) | NOTUMALDH1A1CDK5CDK5R1CYP1A2 | |
| SCHEMBL14704031 | 0.88 | NOTUM (0.43) | NOTUMALDH1A1CYP1A2KDM4EHPGD | |
| SCHEMBL12333458 | 0.85 | CPB2 (0.47) | NOTUMALDH1A1CDK5CDK5R1CYP1A2 | |
| SCHEMBL14631486 | 0.85 | CPB2 (0.49) | NOTUMALDH1A1CDK5CDK5R1TSHR |
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-115461338-B | 3-azabicyclo (3.1.0) hexane derivatives having KDM5 inhibitory activity and uses thereof | 小野药品工业株式会社 | 2024-02-20 | — | — | CN | disclosed |
| CN-115461338-A | 3-azabicyclo (3.1.0) hexane derivatives having KDM5 inhibitory activity and uses thereof | 小野药品工业株式会社 | 2022-12-09 | — | — | CN | disclosed |