Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TPMT | P51580 | 1/20 | 0.35 |
| ▸ | ACACB | O00763 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | CCR3 | P51677 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL27628648 | 0.83 | CYP1A2 (0.44) | CYP3A4ALDH1A1TSHRMAPT | |
| SCHEMBL61038 | 0.82 | CYP3A4 (0.50) | CYP3A4ALDH1A1TSHRKDM4EMAPT | |
| SCHEMBL29034768 | 0.81 | MAPT (0.44) | ACACBCYP3A4ALDH1A1CA1CA2 | |
| 1'-Acetoxychavicol Acetate SCHEMBL3673490 | 0.81 | LMNA (0.47) | CYP3A4ALDH1A1SLC6A3TSHRKDM4E | |
| SCHEMBL9472147 | 0.81 | CYP3A4 (0.46) | CYP3A4ALDH1A1TSHRKDM4EMAPT | |
| 1'-Acetoxychavicol Acetate SCHEMBL17454871 | 0.81 | LMNA (0.47) | CYP3A4ALDH1A1SLC6A3TSHRKDM4E | |
| SCHEMBL9642843 | 0.80 | PTGS2 (0.46) | ACACBCYP3A4ALDH1A1MAPT | |
| SCHEMBL5638474 | 0.79 | ALDH1A1 (0.45) | CYP3A4ALDH1A1CA1CA2TSHR | |
| SCHEMBL8947205 | 0.76 | LMNA (0.46) | ACACBCYP3A4ALDH1A1TSHR | |
| SCHEMBL7948698 | 0.76 | CYP3A4 (0.44) | CYP3A4ALDH1A1TSHRKDM4EMAPT |
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-116396185-B | Preparation method of N-allyl aryl hydrazine compound | 江西师范大学 | 2023-08-18 | — | — | CN | disclosed |
| CN-116396185-A | Preparation method of N-allyl aryl hydrazine compound | 江西师范大学 | 2023-07-07 | — | — | CN | disclosed |