Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.47 |
| ▸ | POLB | P06746 | 4/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 5/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 4/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.45 |
| ▸ | RECQL | P46063 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11400809 | 0.82 | CYP2C19 (0.54) | ALDH1A1POLBHPGDHTTMAPT | |
| SCHEMBL27482821 | 0.78 | POLB (0.45) | ALDH1A1SMN1; SMN2POLBHPGDHTT | |
| SCHEMBL27864383 | 0.73 | CNR1 (0.49) | ALDH1A1SMN1; SMN2POLBHPGDHTT | |
| SCHEMBL28096025 | 0.73 | SLC6A3 (0.41) | ALDH1A1SMN1; SMN2HPGDRAB9AKMT2A | |
| SCHEMBL13988109 | 0.73 | CES2 (0.47) | ALDH1A1SMN1; SMN2POLBHPGDHTT | |
| SCHEMBL27908862 | 0.73 | ALDH1A1 (0.46) | ALDH1A1POLBHPGDHTTMAPT | |
| SCHEMBL28096032 | 0.72 | L3MBTL1 (0.47) | ALDH1A1SMN1; SMN2POLBHPGDHTT | |
| SCHEMBL13026686 | 0.71 | ALOX5 (0.42) | ALDH1A1SMN1; SMN2POLBHPGDMAPT | |
| SCHEMBL7607466 | 0.71 | ALOX5 (0.42) | ALDH1A1SMN1; SMN2POLBHPGDMAPT | |
| SCHEMBL27891940 | 0.71 | CES2 (0.46) | ALDH1A1SMN1; SMN2POLBHPGDMAPT |
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-105924425-B | A kind of method for preparing dihydro sulphur chroman derivative | 浙江师范大学 | 2018-06-05 | — | — | CN | disclosed |
| CN-105924425-A | Preparation method of dihydrothiochroman derivative | 浙江师范大学 | 2016-09-07 | — | — | CN | disclosed |