Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 1.00 |
| ▸ | LMNA | P02545 | 3/20 | 0.71 |
| ▸ | SLC15A2 | Q16348 | 1/20 | 0.71 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.54 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.50 |
| ▸ | ACHE | P22303 | 1/20 | 0.47 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | THPO | P40225 | 1/20 | 0.42 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.42 |
| ▸ | LCK | P06239 | 1/20 | 0.42 |
| ▸ | FYN | P06241 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | KDM6B | O15054 | 1/20 | 0.40 |
| ▸ | KDM5C | P41229 | 1/20 | 0.40 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.40 |
| ▸ | PHF8 | Q9UPP1 | 1/20 | 0.40 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | MGAM | O43451 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10001 | 1.00 | — | — | |
| SCHEMBL11615492 | 0.95 | — | — | |
| SCHEMBL6669487 | 0.95 | — | — | |
| SCHEMBL6801343 | 0.95 | — | — | |
| Formaldehyde SCHEMBL2873057 | 0.91 | ALDH1A1 (0.83) | ALDH1A1LMNASLC15A2TDP1TRPA1 | |
| SCHEMBL9856678 | 0.88 | ALDH1A1 (0.77) | ALDH1A1LMNASLC15A2TDP1TRPA1 | |
| SCHEMBL2439884 | 0.88 | ALDH1A1 (0.77) | ALDH1A1LMNASLC15A2TDP1TRPA1 | |
| Alcohol SCHEMBL137775 | 0.88 | ALDH1A1 (0.77) | ALDH1A1LMNASLC15A2TDP1TRPA1 | |
| SCHEMBL8155389 | 0.88 | ALDH1A1 (0.77) | ALDH1A1LMNASLC15A2TDP1TRPA1 | |
| SCHEMBL1412934 | 0.88 | — | — |
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-105392782-A | Methods for producing fuels, gasoline additives, and lubricants | UNIV CALIFORNIA | 2016-03-09 | — | — | CN | disclosed |
| CN-105348056-A | Method for synthesizing 2,5-hexanedione by two-phase process | SHANXI COAL CHEM INST | 2016-02-24 | — | — | CN | disclosed |