Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | ELANE | P08246 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28674344 | 0.80 | MMP1 (0.38) | LTA4HELANEALDH1A1TSHRCYP3A4 | |
| SCHEMBL4482455 | 0.68 | ELANE (0.42) | ELANEALDH1A1TSHRTDP1L3MBTL1 | |
| SCHEMBL317686 | 0.63 | TSHR (0.58) | LTA4HALDH1A1TSHRCYP3A4MAPK1 | |
| SCHEMBL1922770 | 0.63 | ELANE (0.47) | POLBELANEALDH1A1TSHRNPSR1 | |
| SCHEMBL144042 | 0.61 | ALDH1A1 (0.54) | LTA4HALDH1A1TSHRTDP1L3MBTL1 | |
| SCHEMBL29098435 | 0.61 | TSHR (0.56) | LTA4HALDH1A1TSHRCYP3A4MAPK1 | |
| SCHEMBL27961981 | 0.61 | TSHR (0.56) | LTA4HALDH1A1TSHRCYP3A4MAPK1 | |
| SCHEMBL9621057 | 0.61 | SIGMAR1 (0.48) | LTA4HALDH1A1TSHRCYP3A4MAPK1 | |
| SCHEMBL27530835 | 0.61 | TSHR (0.56) | LTA4HALDH1A1TSHRCYP3A4MAPK1 | |
| SCHEMBL3438768 | 0.61 | HRH3 (0.57) | ALDH1A1TDP1L3MBTL1SIGMAR1MEN1 |
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-113897627-B | Method for electrochemically preparing five-membered heterocyclic dialkoxy compound | 万华化学集团股份有限公司 | 2023-03-03 | — | — | CN | disclosed |
| CN-113897627-A | Method for electrochemically preparing five-membered heterocyclic dialkoxy compound | 万华化学集团股份有限公司 | 2022-01-07 | — | — | CN | disclosed |