Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | HTR1D | P28221 | 1/20 | 0.40 |
| ▸ | HTR6 | P50406 | 1/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.38 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.37 |
| ▸ | PFKFB3 | Q16875 | 5/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.35 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.34 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7988012 | 0.81 | CYP2A6 (0.45) | CYP2A6HTR1DHTR6HSD11B1PIK3CB | |
| SCHEMBL18029231 | 0.76 | HTR6 (0.60) | CYP2A6HTR1DHTR6HSD11B1PFKFB3 | |
| SCHEMBL22010018 | 0.74 | MAPT (0.45) | CYP2A6HTR1DHSD11B1PIK3CBMAPT | |
| SCHEMBL7520854 | 0.73 | CYP2A6 (0.53) | CYP2A6HSD11B1PIK3CBPFKFB3MAPT | |
| SCHEMBL23185433 | 0.72 | WNT1 (0.44) | CYP2A6HSD11B1PIK3CBMAPT | |
| SCHEMBL17384770 | 0.72 | LRRK2 (0.55) | PIK3CBPFKFB3MAPTLRRK2 | |
| SCHEMBL7528332 | 0.72 | IDO1 (0.50) | CYP2A6LRRK2 | |
| SCHEMBL18029140 | 0.72 | HSD11B1 (0.55) | CYP2A6HTR1DHTR6HSD11B1 | |
| SCHEMBL19903845 | 0.70 | HTR1D (0.59) | CYP2A6HTR1DHTR6HSD11B1MAPT | |
| SCHEMBL3348340 | 0.70 | PRKCI (0.56) | HSD11B1PIK3CBLRRK2CYP11B1CYP11B2 |
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 |