Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | GAA | P10253 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | G6PD | P11413 | 1/20 | 0.44 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL29393893 | 0.78 | CYP2C19 (0.47) | ALDH1A1GAALMNATSHRCYP1A2 | |
| SCHEMBL599369 | 0.78 | CYP2C19 (0.47) | ALDH1A1GAALMNATSHRCYP1A2 | |
| SCHEMBL3686863 | 0.75 | ALDH1A1 (0.49) | ALDH1A1GAALMNATSHRCYP1A2 | |
| SCHEMBL5072462 | 0.75 | ALDH1A1 (0.58) | ALDH1A1GAALMNATSHRCYP1A2 | |
| SCHEMBL11824508 | 0.72 | ALDH1A1 (0.54) | ALDH1A1GAALMNATSHRCYP1A2 | |
| SCHEMBL9416923 | 0.72 | CYP2C19 (0.47) | ALDH1A1GAALMNATSHRCYP1A2 | |
| SCHEMBL29442910 | 0.72 | ALOX15 (0.60) | ALDH1A1GAALMNATSHRCYP1A2 | |
| SCHEMBL4899794 | 0.72 | ALOX15 (0.60) | ALDH1A1GAALMNATSHRCYP1A2 | |
| SCHEMBL11002684 | 0.71 | HSPA5 (0.68) | ALDH1A1GAALMNATSHRCYP1A2 | |
| SCHEMBL15129714 | 0.71 | ALDH1A1 (0.49) | ALDH1A1GAALMNATSHRCYP1A2 |
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-109134202-A | The method that lignin cracking prepares 2,6 di tert butyl 4 methyl phenol | 北京联合大学 | 2019-01-04 | — | — | CN | disclosed |