Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | WDR5 | P61964 | 1/20 | 0.68 |
| ▸ | CFTR | P13569 | 1/20 | 0.49 |
| ▸ | LDHA | P00338 | 1/20 | 0.49 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.47 |
| ▸ | KDM4A | O75164 | 1/20 | 0.45 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.45 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.45 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.45 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.44 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.44 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL14052342 | 0.88 | ALDH1A1 (0.50) | WDR5CFTRKEAP1OPRM1OPRD1 | |
| SCHEMBL27436039 | 0.84 | WDR5 (0.51) | WDR5CFTRLDHAKDM4ANR4A1 | |
| SCHEMBL14052388 | 0.83 | KEAP1 (0.51) | WDR5CFTRKEAP1OPRM1OPRD1 | |
| SCHEMBL29721418 | 0.82 | WDR5 (1.00) | WDR5LDHANR4A1NR4A2NR4A3 | |
| SCHEMBL895573 | 0.82 | WDR5 (1.00) | WDR5LDHANR4A1NR4A2NR4A3 | |
| SCHEMBL14052934 | 0.82 | KEAP1 (0.50) | WDR5CFTRKEAP1OPRM1OPRD1 | |
| SCHEMBL10013780 | 0.82 | KEAP1 (0.44) | WDR5CFTRKEAP1OPRM1OPRD1 | |
| SCHEMBL14052470 | 0.82 | MEN1 (0.44) | WDR5CFTRKEAP1KDM4AOPRM1 | |
| SCHEMBL14052573 | 0.81 | KEAP1 (0.43) | WDR5CFTRKEAP1OPRM1OPRD1 | |
| SCHEMBL16863847 | 0.80 | CFTR (0.68) | CFTRLDHAKDM4AOPRM1OPRD1 |
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-113200884-B | Chiral carboxylic acid compound and synthesis method and application thereof | 浙江大学 | 2022-07-22 | — | — | CN | disclosed |
| CN-113200884-A | Chiral carboxylic acid compound and synthesis method and application thereof | 浙江大学 | 2021-08-03 | — | — | CN | disclosed |