Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | MAOA | P21397 | 1/20 | 0.50 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.50 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.50 |
| ▸ | HTR2B | P41595 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | UGT2B7 | P16662 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 3/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.32 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.32 |
| ▸ | AKR1C3 | P42330 | 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 | |
|---|---|---|---|---|
| SCHEMBL12529817 | 0.79 | LMNA (0.35) | CYP3A4CHRM1ALOX15MAOATBXA2R | |
| SCHEMBL12533349 | 0.79 | HTR2B (0.48) | CYP3A4CHRM1ALOX15MAOATBXA2R | |
| SCHEMBL13560059 | 0.79 | UGT2B7 (0.38) | ADRA1AUGT2B7ALDH1A1LMNATRPA1 | |
| SCHEMBL8950753 | 0.77 | HSD17B10 (0.43) | CYP3A4ALOX15ADRA1AUGT2B7ALDH1A1 | |
| SCHEMBL22991576 | 0.77 | CA1 (0.50) | CYP3A4L3MBTL1UGT2B7ALDH1A1GAA | |
| SCHEMBL12529998 | 0.75 | SMN1; SMN2 (0.37) | CYP3A4ALOX15ADRA1AUGT2B7ALDH1A1 | |
| SCHEMBL2278134 | 0.75 | ADRB2 (0.46) | CYP3A4CHRM1ALOX15MAOATBXA2R | |
| SCHEMBL31079407 | 0.75 | ALDH1A1 (0.38) | UGT2B7ALDH1A1LMNATRPA1PTGS1 | |
| SCHEMBL27875873 | 0.75 | ADRB2 (0.46) | CYP3A4CHRM1ALOX15MAOATBXA2R | |
| SCHEMBL9331671 | 0.74 | UGT2B7 (0.46) | ALOX15UGT2B7ALDH1A1MAPTLMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-117836301-A | 2, 2-difluoro-5H- [1,3] dioxolo [4,5-F ] isoindol-7-one derivatives as pesticides | 先正达农作物保护股份公司 | 2024-04-05 | — | — | CN | disclosed |
| CN-108473402-A | Process for preparing substituted 2-arylethanols | 拜耳作物科学股份公司 | 2018-08-31 | — | — | CN | disclosed |