Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK3 | O43781 | 1/20 | 0.54 |
| ▸ | CLK1 | P49759 | 1/20 | 0.54 |
| ▸ | CLK2 | P49760 | 1/20 | 0.54 |
| ▸ | CLK3 | P49761 | 1/20 | 0.54 |
| ▸ | GSK3B | P49841 | 1/20 | 0.54 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.54 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.54 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.54 |
| ▸ | DYRK2 | Q92630 | 1/20 | 0.54 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.54 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.54 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.51 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | JAK2 | O60674 | 1/20 | 0.50 |
| ▸ | ACLY | P53396 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL15866404 | 0.81 | NAMPT (0.47) | DYRK3CLK2DYRK1ACLK4ROCK2 | |
| SCHEMBL30374957 | 0.80 | ALDH1A1 (0.54) | ALDH1A1NAMPTMAPTPOLBCDK2 | |
| SCHEMBL25179894 | 0.80 | ALDH1A1 (0.54) | ALDH1A1NAMPTMAPTPOLBCDK2 | |
| SCHEMBL1460717 | 0.79 | ALDH1A1 (0.80) | ROCK2ROCK1RAB9AALDH1A1NPC1 | |
| SCHEMBL3058692 | 0.78 | MAPK1 (0.55) | DYRK3CLK1CLK2CLK3GSK3B | |
| SCHEMBL29509879 | 0.78 | NOS1 (0.55) | DYRK3CLK1CLK2CLK3GSK3B | |
| SCHEMBL6298004 | 0.78 | NOS1 (0.51) | DYRK3CLK1CLK2CLK3GSK3B | |
| SCHEMBL5220947 | 0.78 | KDR (0.57) | DYRK3CLK1CLK2CLK3GSK3B | |
| SCHEMBL10179696 | 0.78 | TMEM97 (0.52) | DYRK3CLK1CLK2CLK3GSK3B | |
| SCHEMBL31647068 | 0.78 | KDR (0.57) | DYRK3CLK1CLK2CLK3GSK3B |
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 |
|---|---|---|---|---|---|---|---|
| US-4096333-A | NITROSATION OF A 2-METHYLACETANILIDE | TENNECO CHEMICALS, INC. (US) | 1978-06-20 | — | — | US | disclosed |
| US-3988347-A | NITROSATION OF A 2-METHYL-ACETANILIDE WITH SODIUM NITRITE | TENNECO CHEMICALS, INC. (US) | 1976-10-26 | — | — | US | disclosed |