Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | CLK1 | P49759 | 2/20 | 0.47 |
| ▸ | CLK2 | P49760 | 2/20 | 0.47 |
| ▸ | CLK3 | P49761 | 2/20 | 0.47 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.47 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.47 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.47 |
| ▸ | FAAH | O00519 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | PDE5A | O76074 | 4/20 | 0.45 |
| ▸ | PDE2A | O00408 | 1/20 | 0.45 |
| ▸ | PDE8A | O60658 | 1/20 | 0.45 |
| ▸ | PDE6A | P16499 | 1/20 | 0.45 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.45 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.45 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL28232052 | 0.77 | RAB9A (0.56) | MAPTCLK1CLK2CLK3DYRK1A | |
| SCHEMBL109195 | 0.76 | TAAR1 (0.64) | CYP1A2CYP3A4MAPTALDH1A1TAAR1 | |
| SCHEMBL108697 | 0.75 | ALDH1A1 (0.51) | CYP1A2CYP3A4MAPTALDH1A1HSD17B10 | |
| Aminothiazole SCHEMBL28843713 | 0.74 | ALDH1A1 (0.49) | CYP1A2CYP3A4MAPTCLK1CLK2 | |
| SCHEMBL28291971 | 0.74 | FAAH (0.48) | CYP1A2MAPTFAAHALDH1A1PDE5A | |
| SCHEMBL108109 | 0.74 | TAAR1 (0.62) | CYP1A2CYP3A4MAPTALDH1A1TAAR1 | |
| SCHEMBL108235 | 0.72 | TAAR1 (0.55) | CYP1A2CYP3A4MAPTALDH1A1HSD17B10 | |
| SCHEMBL12283582 | 0.71 | ALDH1A1 (0.45) | CYP1A2CYP3A4MAPTALDH1A1HSD17B10 | |
| SCHEMBL23366762 | 0.71 | L3MBTL1 (0.70) | CYP1A2CYP3A4DYRK1ACLK4ALDH1A1 | |
| SCHEMBL28150474 | 0.71 | ALDH1A1 (0.47) | CYP1A2CYP3A4MAPTALDH1A1HSD17B10 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106188030-B | N- (5- piperonyls thiazol-2-yl) chlorinated amide derivative | 长沙理工大学 | 2018-08-21 | — | — | CN | disclosed |
| CN-107365308-A | N- (5- piperonyls thiazol-2-yl) amide derivatives and its application as antineoplastic | 湖南大学 | 2017-11-21 | — | — | CN | disclosed |
| CN-107286149-A | N‑（The base of 5 piperonyl thiazole 2）Piperidyl amide and its application | 南华大学 | 2017-10-24 | — | — | CN | disclosed |
| CN-106188030-A | N (5 piperonyl thiazole 2 base) chlorinated amide derivant | 长沙理工大学 | 2016-12-07 | — | — | CN | disclosed |
| CN-106188030-A | N (5 piperonyl thiazole 2 base) chlorinated amide derivant | 长沙理工大学 | 2016-12-07 | — | — | CN | disclosed |