Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 6/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.37 |
| ▸ | NAAA | Q02083 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.34 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28631996 | 0.89 | MEN1 (0.38) | ALDH1A1TSHRHCAR2MEN1KMT2A | |
| SCHEMBL8397276 | 0.86 | ALDH1A1 (0.44) | ALDH1A1TSHRHPGDATMHCAR2 | |
| SCHEMBL28432881 | 0.84 | MEN1 (0.44) | ALDH1A1TSHRHPGDATMHCAR2 | |
| SCHEMBL7722774 | 0.83 | MEN1 (0.52) | ALDH1A1TSHRATMMEN1KMT2A | |
| SCHEMBL28897274 | 0.83 | MEN1 (0.43) | ALDH1A1TSHRHPGDATMHCAR2 | |
| SCHEMBL31522371 | 0.82 | MEN1 (0.36) | ALDH1A1TSHRHCAR2MEN1KMT2A | |
| SCHEMBL7709450 | 0.80 | MEN1 (0.49) | ALDH1A1TSHRHPGDATMMEN1 | |
| SCHEMBL7254507 | 0.80 | ALDH1A1 (0.33) | ALDH1A1TSHRHPGDATMKMT2A | |
| SCHEMBL18704240 | 0.78 | ALDH1A1 (0.47) | ALDH1A1TSHRHPGDATMHCAR2 | |
| SCHEMBL28063767 | 0.77 | MEN1 (0.36) | ALDH1A1TSHRMEN1KMT2ALMNA |
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-113200844-A | Preparation method of sodium valproate | 上海青平药业有限公司 | 2021-08-03 | — | — | CN | claimed |
| CN-113200844-A | Preparation method of sodium valproate | 上海青平药业有限公司 | 2021-08-03 | — | — | CN | disclosed |