Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | WDR5 | P61964 | 1/20 | 0.68 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | LDHA | P00338 | 1/20 | 0.49 |
| ▸ | PSEN1 | P49768 | 3/20 | 0.47 |
| ▸ | PSEN2 | P49810 | 3/20 | 0.47 |
| ▸ | APH1B | Q8WW43 | 3/20 | 0.47 |
| ▸ | NCSTN | Q92542 | 3/20 | 0.47 |
| ▸ | APH1A | Q96BI3 | 3/20 | 0.47 |
| ▸ | PSENEN | Q9NZ42 | 3/20 | 0.47 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.45 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.45 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.45 |
| ▸ | SOS1 | Q07889 | 2/20 | 0.43 |
| ▸ | CDC25B | P30305 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL895573 | 0.82 | WDR5 (1.00) | WDR5TSHRLDHANR4A1NR4A2 | |
| SCHEMBL29721418 | 0.82 | WDR5 (1.00) | WDR5TSHRLDHANR4A1NR4A2 | |
| SCHEMBL28623995 | 0.79 | WDR5 (0.68) | WDR5TSHRLDHANR4A1NR4A2 | |
| SCHEMBL28616134 | 0.78 | WDR5 (0.66) | WDR5LDHAPSEN1PSEN2APH1B | |
| SCHEMBL8174124 | 0.78 | TSHR (0.56) | TSHRPSEN1PSEN2APH1BNCSTN | |
| SCHEMBL28633025 | 0.77 | WDR5 (0.68) | WDR5LDHANR4A1NR4A2NR4A3 | |
| SCHEMBL14225351 | 0.76 | WDR5 (0.79) | WDR5TSHRLDHANR4A1NR4A2 | |
| SCHEMBL21891698 | 0.76 | ALDH1A1 (0.56) | TSHRNR4A1ALDH1A1HPGDKDM4E | |
| SCHEMBL28633006 | 0.75 | WDR5 (0.60) | WDR5LDHANR4A1NR4A2NR4A3 | |
| SCHEMBL2240626 | 0.74 | WDR5 (0.81) | WDR5TSHRLDHANR4A1NR4A2 |
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 |