Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | ADH1B | P00325 | 1/20 | 0.31 |
| ▸ | ADH1C | P00326 | 1/20 | 0.31 |
| ▸ | ADH1A | P07327 | 1/20 | 0.31 |
| ▸ | ADH7 | P40394 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | MGLL | Q99685 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7670381 | 0.77 | ALDH1A1 (0.39) | ALDH1A1NPSR1ALOX15HTTMEN1 | |
| SCHEMBL8587430 | 0.77 | ALDH1A1 (0.39) | ALDH1A1NPSR1ALOX15HTTMEN1 | |
| SCHEMBL8488708 | 0.76 | ALDH1A1 (0.48) | ALDH1A1NPSR1ALOX15MEN1KMT2A | |
| SCHEMBL7665930 | 0.74 | NPSR1 (0.41) | ALDH1A1NPSR1ALOX15HTTMEN1 | |
| SCHEMBL11502605 | 0.72 | ALDH1A1 (0.35) | ALDH1A1NPSR1ALOX15HTTMEN1 | |
| SCHEMBL7659796 | 0.72 | ALDH1A1 (0.38) | ALDH1A1HTTMEN1KMT2AADH1B | |
| SCHEMBL6963070 | 0.71 | MTNR1A (0.43) | ALDH1A1NPSR1ALOX15HTTMEN1 | |
| SCHEMBL8633008 | 0.71 | KCNN4 (0.39) | ALDH1A1NPSR1ALOX15CYP2A6TRPM8 | |
| SCHEMBL7668451 | 0.71 | NPSR1 (0.39) | ALDH1A1NPSR1ALOX15HTTMEN1 | |
| SCHEMBL7662987 | 0.70 | TDP1 (0.56) | ALDH1A1ALOX15KMT2ATDP1L3MBTL1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106397420-B | 3- (5- aryl-1,3,4-oxdiazole -2- bases) asarinin analog derivative, preparation method and application | 郑州大学 | 2018-10-09 | — | — | CN | claimed |
| CN-106397420-A | 3-(5-aryl-1,3-4-oxadiazole-2-yl)sarisan derivatives, and preparation method and application thereof | 郑州大学 | 2017-02-15 | — | — | CN | claimed |
| CN-106397420-B | 3- (5- aryl-1,3,4-oxdiazole -2- bases) asarinin analog derivative, preparation method and application | 郑州大学 | 2018-10-09 | — | — | CN | disclosed |
| CN-106397420-A | 3-(5-aryl-1,3-4-oxadiazole-2-yl)sarisan derivatives, and preparation method and application thereof | 郑州大学 | 2017-02-15 | — | — | CN | disclosed |