Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.41 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ESRRA | P11474 | 1/20 | 0.39 |
| ▸ | PMM2 | O15305 | 1/20 | 0.39 |
| ▸ | MPI | P34949 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | PHOSPHO1 | Q8TCT1 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL28643394 | 0.81 | ALDH1A1 (0.41) | ALDH1A1HPGDMAPTPDE4DSMN1; SMN2 | |
| SCHEMBL28657005 | 0.80 | ALDH1A1 (0.41) | TP53GAAALDH1A1HPGDCYP1A2 | |
| SCHEMBL28643803 | 0.79 | MAP3K5 (0.53) | TP53GAAALDH1A1HPGDCYP1A2 | |
| SCHEMBL21649342 | 0.69 | TP53 (0.38) | TP53GAAALDH1A1HPGDCYP1A2 | |
| SCHEMBL3933287 | 0.68 | KMO (0.54) | GAAALDH1A1HPGDMAPTPDE4D | |
| SCHEMBL20672216 | 0.67 | MAP3K5 (0.43) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL10145136 | 0.67 | GAA (0.53) | TP53GAAALDH1A1HPGDCYP1A2 | |
| SCHEMBL244928 | 0.67 | ALDH1A1 (0.61) | TP53GAAALDH1A1HPGDCYP1A2 | |
| SCHEMBL29641404 | 0.66 | GAA (0.56) | TP53GAAALDH1A1HPGDCYP1A2 | |
| SCHEMBL7830816 | 0.66 | ALDH1A1 (0.54) | TP53GAAALDH1A1HPGDCYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109400625-B | Fused bicyclic compound and application thereof in medicine | 广东东阳光药业有限公司 | 2021-11-12 | — | — | CN | disclosed |