Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.44 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.37 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.37 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ITGAV | P06756 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL707747 | 0.82 | ALDH1A1 (0.49) | KEAP1NFE2L2ALDH1A1ALOX12HTT | |
| SCHEMBL28240608 | 0.81 | KEAP1 (0.42) | KEAP1NFE2L2ALDH1A1ALOX12HTT | |
| SCHEMBL7194392 | 0.79 | KEAP1 (0.57) | KEAP1NFE2L2ALDH1A1ALOX12HTT | |
| SCHEMBL4250262 | 0.79 | PLCG1 (0.56) | KEAP1NFE2L2ALDH1A1ALOX12HTT | |
| SCHEMBL3882288 | 0.79 | PSIP1 (0.50) | KEAP1NFE2L2ALDH1A1ALOX12HTT | |
| SCHEMBL9712135 | 0.76 | LMNA (0.46) | NFE2L2ALDH1A1HTTTSHRKMT2A | |
| SCHEMBL16299843 | 0.76 | HTR6 (0.51) | ALDH1A1TSHRPOLBKMT2ASMN1; SMN2 | |
| SCHEMBL27781826 | 0.75 | KEAP1 (0.38) | KEAP1NFE2L2ALDH1A1ALOX12HTT | |
| SCHEMBL8765877 | 0.75 | KEAP1 (0.46) | KEAP1NFE2L2ALDH1A1ALOX12HTT | |
| SCHEMBL11692985 | 0.75 | KEAP1 (0.46) | KEAP1NFE2L2ALDH1A1ALOX12HTT |
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-103012455-A | Preparation method of alpha-alkenyl boronic acid pinacol esters | LIANHUA CHEMISTRY CO LTD DALIAN | 2013-04-03 | — | — | CN | disclosed |
| EP-0163996-A1 | 2,2-Dimethyl-3-formylcyclopropanes and process for their preparation | BAYER AG (DE) | 1985-12-11 | — | — | EP | disclosed |