Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 3/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | KIF11 | P52732 | 3/20 | 0.37 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.36 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | MPL | P40238 | 1/20 | 0.33 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.33 |
| ▸ | FEN1 | P39748 | 1/20 | 0.33 |
| ▸ | GYS1 | P13807 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21241363 | 0.83 | ADORA2A (0.45) | PTGS2PTGS1GYS1 | |
| SCHEMBL21241364 | 0.79 | SDHB (0.39) | PTGS2PTGS1 | |
| SCHEMBL21241176 | 0.78 | ALOX5 (0.44) | TRPA1PTGS2PTGS1IDO1MAOB | |
| SCHEMBL21241499 | 0.78 | LMNA (0.46) | PTGS1ESR1ESR2 | |
| SCHEMBL22598437 | 0.75 | KIF11 (0.45) | TRPA1KIF11MAOBGYS1 | |
| SCHEMBL21241236 | 0.72 | MKNK1 (0.35) | PTGS2 | |
| SCHEMBL21241178 | 0.69 | PTGS2 (0.41) | PTGS2 | |
| SCHEMBL21241365 | 0.68 | ADORA2A (0.43) | PTGS2PTGS1 | |
| SCHEMBL21199950 | 0.64 | ESR1 (0.61) | HSD17B1HSD17B2ESR1ESR2 | |
| SCHEMBL21241509 | 0.64 | CES2 (0.31) | NOTUM |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019149260-A1 | PYRIDAZINOL COMPOUND, DERIVATIVE THEREOF, PREPARATION METHOD THEREFOR, HERBICIDAL COMPOSITION AND USE THEREOF | 青岛清原化合物有限公司 | 2019-08-08 | — | — | WO | disclosed |