Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXAS1 | P24557 | 1/20 | 0.41 |
| ▸ | PDE10A | Q9Y233 | 13/20 | 0.39 |
| ▸ | CD38 | P28907 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | PIM1 | P11309 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL22952759 | 0.78 | TBXAS1 (0.38) | TBXAS1PDE10ACD38ALDH1A1PIM1 | |
| SCHEMBL21233171 | 0.71 | ALDH1A1 (0.36) | CYP1A2CYP3A4SMN1; SMN2ALDH1A1 | |
| SCHEMBL12090639 | 0.71 | ALDH1A1 (0.51) | PDE10ACYP1A2CYP3A4SMN1; SMN2ALDH1A1 | |
| SCHEMBL15885324 | 0.70 | KEAP1 (0.44) | TBXAS1PDE10ACD38 | |
| SCHEMBL21233152 | 0.69 | CYP11B2 (0.44) | TBXAS1PDE10ACD38CYP11B2SMN1; SMN2 | |
| SCHEMBL21233170 | 0.69 | ALDH1A1 (0.37) | CYP1A2CYP3A4SMN1; SMN2ALDH1A1 | |
| SCHEMBL21233334 | 0.68 | PIM1 (0.37) | PDE10ACYP11B1CYP11B2CYP1A2CYP3A4 | |
| SCHEMBL21241322 | 0.68 | NMT1 (0.41) | CYP11B1CYP11B2CYP1A2CYP3A4SMN1; SMN2 | |
| SCHEMBL21233175 | 0.68 | ALDH1A1 (0.33) | CYP1A2CYP3A4SMN1; SMN2ALDH1A1 | |
| SCHEMBL571374 | 0.66 | HDAC8 (0.50) | TBXAS1CD38SMN1; SMN2ALDH1A1PIM1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019148851-A1 | FIVE-MEMBERED RING-SUBSTITUTED PYRIDAZINOL COMPOUND AND DERIVATIVES THEREOF, PREPARATION METHOD, HERBICIDAL COMPOSITION, AND APPLICATION | 青岛清原化合物有限公司 | 2019-08-08 | — | — | WO | disclosed |
| 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 |