Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 5/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 5/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 4/20 | 0.34 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.32 |
| ▸ | TDO2 | P48775 | 1/20 | 0.32 |
| ▸ | GRM5 | P41594 | 1/20 | 0.32 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.31 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.30 |
| ▸ | KDR | P35968 | 1/20 | 0.30 |
| ▸ | PDE2A | O00408 | 1/20 | 0.30 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.30 |
| ▸ | ATM | Q13315 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL31417903 | 0.78 | CYP2A6 (0.44) | CYP2A6CYP11B2CYP11B1HCAR2GRM5 | |
| SCHEMBL25488567 | 0.74 | ALDH1A1 (0.53) | — | |
| SCHEMBL30442984 | 0.74 | ALDH1A1 (0.53) | — | |
| SCHEMBL18670135 | 0.74 | CYP11B2 (0.39) | CYP11B2CYP11B1FGFR3KDR | |
| SCHEMBL3721048 | 0.72 | ALDH1A1 (0.47) | — | |
| SCHEMBL3423606 | 0.72 | CYP2A6 (0.61) | CYP2A6CYP11B2CYP11B1HCAR2TDO2 | |
| SCHEMBL20153302 | 0.70 | CYP2A6 (0.54) | CYP2A6CYP11B2CYP11B1 | |
| SCHEMBL3421746 | 0.70 | CYP2A6 (0.59) | CYP2A6CYP11B2CYP11B1HCAR2TDO2 | |
| SCHEMBL3426054 | 0.70 | CYP2A6 (0.59) | CYP2A6CYP11B2CYP11B1HCAR2TDO2 | |
| SCHEMBL31418156 | 0.69 | HSD17B1 (0.46) | CYP11B2CYP11B1 |
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 |