Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.69 |
| ▸ | MAPT | P10636 | 11/20 | 0.69 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.69 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.69 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.69 |
| ▸ | LMNA | P02545 | 3/20 | 0.67 |
| ▸ | POLB | P06746 | 1/20 | 0.67 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.56 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.55 |
| ▸ | PKM | P14618 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 2/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | CTSB | P07858 | 1/20 | 0.54 |
| ▸ | AR | P10275 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL22094803 | 0.98 | ALDH1A1 (0.68) | ALDH1A1MAPTCYP1A2CYP2C19L3MBTL1 | |
| SCHEMBL3538126 | 0.98 | ALDH1A1 (0.68) | ALDH1A1MAPTCYP1A2CYP2C19L3MBTL1 | |
| SCHEMBL27646270 | 0.87 | MAPT (0.53) | ALDH1A1MAPTCYP1A2CYP2C19L3MBTL1 | |
| SCHEMBL28038606 | 0.87 | ALDH1A1 (0.67) | ALDH1A1MAPTCYP1A2CYP2C19L3MBTL1 | |
| SCHEMBL5322795 | 0.86 | ALDH1A1 (0.64) | ALDH1A1MAPTCYP1A2CYP2C19L3MBTL1 | |
| SCHEMBL3154116 | 0.86 | MAPT (0.64) | ALDH1A1MAPTCYP1A2CYP2C19LMNA | |
| SCHEMBL1110499 | 0.85 | GAA (0.69) | ALDH1A1MAPTCYP1A2CYP2C19L3MBTL1 | |
| SCHEMBL3485338 | 0.85 | GAA (0.69) | ALDH1A1MAPTCYP1A2CYP2C19L3MBTL1 | |
| SCHEMBL30783659 | 0.83 | MAPT (0.59) | ALDH1A1MAPTCYP1A2CYP2C19L3MBTL1 | |
| SCHEMBL5374258 | 0.82 | MAPT (0.48) | ALDH1A1MAPTCYP1A2CYP2C19L3MBTL1 |
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-105037386-B | Tetrahydrobenzo [ c ] [1,2,5] oxadiazine compound and preparation method thereof | 大连理工大学 | 2017-10-24 | — | — | CN | disclosed |
| CN-105037386-A | Tetrahydrobenzo [ c ] [1,2,5] oxadiazine compound and preparation method thereof | UNIV DALIAN TECH | 2015-11-11 | — | — | CN | disclosed |