Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | APP | P05067 | 4/20 | 0.38 |
| ▸ | YWHAG | P61981 | 1/20 | 0.38 |
| ▸ | CHRM5 | P08912 | 6/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 6/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 4/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | TYR | P14679 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28342441 | 0.83 | NPC1 (0.46) | LMNANPC1ALDH1A1TP53MAPT | |
| SCHEMBL28342389 | 0.77 | CHRM5 (0.53) | KCNH2CHRM5CHRM1CHRM3CHRM4 | |
| SCHEMBL28342443 | 0.77 | CHRM1 (0.50) | LMNAKCNH2APPYWHAGCHRM5 | |
| SCHEMBL3800131 | 0.76 | CA2 (0.46) | LMNAKCNJ1KCNH2NPC1ALDH1A1 | |
| SCHEMBL28342373 | 0.73 | CHRM1 (0.44) | KCNH2CHRM5CHRM1CHRM3CHRM4 | |
| SCHEMBL28339934 | 0.73 | CHRM5 (0.48) | KCNH2CHRM5CHRM1CHRM3CHRM4 | |
| SCHEMBL19812842 | 0.73 | KDM4E (0.45) | KCNJ1KCNH2ALDH1A1MAPT | |
| SCHEMBL6289134 | 0.73 | TAAR1 (0.47) | LMNAALDH1A1TP53MAPT | |
| SCHEMBL30073072 | 0.73 | KDM4E (0.45) | KCNJ1KCNH2ALDH1A1MAPT | |
| SCHEMBL3919296 | 0.73 | TDP1 (0.37) | KCNJ1KCNH2CHRM4 |
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-110612299-A | Pyrimidine derivatives as PGE2 receptor modulators | 爱杜西亚药品有限公司 | 2019-12-24 | — | — | CN | disclosed |