Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD3 | P35462 | 3/20 | 0.44 |
| ▸ | DRD2 | P14416 | 2/20 | 0.44 |
| ▸ | DRD4 | P21917 | 2/20 | 0.44 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.32 |
| ▸ | MAP3K12 | Q12852 | 2/20 | 0.31 |
| ▸ | BRAF | P15056 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | GFER | P55789 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL24680997 | 0.85 | DRD3 (0.58) | DRD3DRD2DRD4PIK3CDHDAC1 | |
| SCHEMBL2718724 | 0.85 | DRD3 (0.44) | DRD3DRD2DRD4MAP3K12BRAF | |
| SCHEMBL24680998 | 0.85 | DRD3 (0.58) | DRD3DRD2DRD4PIK3CDHDAC1 | |
| SCHEMBL5493145 | 0.77 | HDAC1 (0.46) | DRD3DRD2DRD4MAPTHDAC1 | |
| SCHEMBL2729685 | 0.76 | KCNH2 (0.44) | BRAFALDH1A1MAPTGFERKDM4E | |
| SCHEMBL21641736 | 0.76 | KCNH2 (0.44) | BRAFALDH1A1MAPTGFERKDM4E | |
| SCHEMBL5497644 | 0.73 | DRD3 (0.58) | DRD3DRD2DRD4HDAC1AKR1C3 | |
| SCHEMBL2391102 | 0.69 | KDM4E (0.33) | ALDH1A1MAPTGFERHTTKDM4E | |
| SCHEMBL1898615 | 0.69 | MAP3K12 (0.42) | MAP3K12ALDH1A1MAPTGFERHTT | |
| SCHEMBL19381939 | 0.69 | DRD3 (0.44) | DRD3DRD2DRD4MAPTMAPK1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023138362-A1 | WEE1 INHIBITOR, PREPARATION THEREFOR, AND USE THEREOF | 江苏天士力帝益药业有限公司 | 2023-07-27 | — | — | WO | disclosed |