Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | WDR5 | P61964 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | TPH1 | P17752 | 5/20 | 0.39 |
| ▸ | TPH2 | Q8IWU9 | 5/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL871216 | 0.80 | ALDH1A1 (0.44) | TP53HPGDHSD17B10WDR5ALDH1A1 | |
| SCHEMBL2608601 | 0.77 | ALDH1A1 (0.42) | TP53HPGDHSD17B10WDR5ALDH1A1 | |
| SCHEMBL22920064 | 0.76 | ALDH1A1 (0.44) | TP53HPGDHSD17B10WDR5ALDH1A1 | |
| SCHEMBL8188906 | 0.76 | LMNA (0.47) | TP53HPGDHSD17B10WDR5ALDH1A1 | |
| SCHEMBL870351 | 0.75 | HDAC1 (0.45) | TP53HPGDHSD17B10WDR5ALDH1A1 | |
| SCHEMBL25060981 | 0.75 | LMNA (0.46) | TP53HPGDHSD17B10WDR5ALDH1A1 | |
| SCHEMBL23349372 | 0.75 | LMNA (0.46) | TP53HPGDHSD17B10WDR5ALDH1A1 | |
| SCHEMBL25061139 | 0.75 | LMNA (0.46) | TP53HPGDHSD17B10WDR5ALDH1A1 | |
| SCHEMBL25282885 | 0.74 | WDR5 (0.46) | TP53HPGDHSD17B10WDR5ALDH1A1 | |
| SCHEMBL16741185 | 0.73 | ALDH1A1 (0.42) | TP53HPGDHSD17B10WDR5ALDH1A1 |
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-114805346-A | Heterocyclic derivative, preparation method and application thereof | 成都硕德药业有限公司 | 2022-07-29 | — | — | CN | disclosed |