Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | BAZ2B | Q9UIF8 | 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 | |
|---|---|---|---|---|
| SCHEMBL22952406 | 0.78 | HDAC1 (0.30) | — | |
| SCHEMBL21241221 | 0.71 | BRD4 (0.36) | ALDH1A1CYP1A2CYP3A4SMN1; SMN2APOBEC3G | |
| SCHEMBL26847652 | 0.71 | ACHE (0.40) | ALDH1A1CYP1A2CYP3A4SMN1; SMN2APOBEC3G | |
| SCHEMBL31432937 | 0.70 | KMT2A (0.42) | — | |
| SCHEMBL26051626 | 0.69 | ALDH1A1 (0.34) | ALDH1A1CYP1A2CYP3A4SMN1; SMN2APOBEC3G | |
| SCHEMBL21233173 | 0.68 | ALDH1A1 (0.39) | ALDH1A1CYP1A2CYP3A4SMN1; SMN2APOBEC3G | |
| SCHEMBL21233326 | 0.68 | ALDH1A1 (0.36) | ALDH1A1CYP1A2CYP3A4SMN1; SMN2APOBEC3G | |
| SCHEMBL21233179 | 0.68 | TSHR (0.44) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL21233174 | 0.68 | ALDH1A1 (0.39) | ALDH1A1CYP1A2CYP3A4SMN1; SMN2APOBEC3G | |
| SCHEMBL21233161 | 0.68 | CYP11B2 (0.39) | ALDH1A1SMN1; SMN2 |
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-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 |
| 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 |