Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.32 |
| ▸ | BCHE | P06276 | 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 | |
|---|---|---|---|---|
| SCHEMBL22952789 | 0.77 | KDM4E (0.30) | — | |
| SCHEMBL21233114 | 0.70 | CHRM1 (0.39) | ALDH1A1CYP1A2CYP3A4SMN1; SMN2APOBEC3G | |
| SCHEMBL21233193 | 0.70 | ALDH1A1 (0.34) | ALDH1A1CYP1A2CYP3A4SMN1; SMN2APOBEC3G | |
| SCHEMBL21233107 | 0.69 | ALDH1A1 (0.33) | ALDH1A1CYP1A2CYP3A4SMN1; SMN2APOBEC3G | |
| SCHEMBL21233198 | 0.69 | CYP11B2 (0.39) | ALDH1A1 | |
| SCHEMBL26847564 | 0.68 | ALDH1A1 (0.38) | ALDH1A1CYP1A2CYP3A4SMN1; SMN2APOBEC3G | |
| SCHEMBL21233110 | 0.68 | KMT2A (0.44) | ALDH1A1CYP1A2CYP3A4SMN1; SMN2APOBEC3G | |
| SCHEMBL21233344 | 0.67 | ALDH1A1 (0.37) | ALDH1A1CYP1A2CYP3A4SMN1; SMN2APOBEC3G | |
| SCHEMBL26051626 | 0.67 | ALDH1A1 (0.34) | ALDH1A1CYP1A2CYP3A4SMN1; SMN2APOBEC3G | |
| SCHEMBL21240988 | 0.67 | CCR1 (0.63) | 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 1 patent. 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 |