Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TPMT | P51580 | 2/20 | 0.53 |
| ▸ | BPTF | Q12830 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | CNR2 | P34972 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL14024231 | 0.89 | TPMT (0.65) | TPMTBPTFCYP3A4KDM4EMAPT | |
| Methyl Syringate SCHEMBL211747 | 0.87 | MEN1 (0.61) | TPMTCYP3A4KDM4EMEN1KMT2A | |
| SCHEMBL398872 | 0.84 | BPTF (0.56) | TPMTBPTFCYP3A4KDM4EMEN1 | |
| SCHEMBL3544388 | 0.84 | TPMT (0.69) | TPMTBPTFKDM4EKMT2AMAPT | |
| SCHEMBL7122014 | 0.84 | LMNA (0.58) | TPMTBPTFMEN1KMT2AMAPT | |
| SCHEMBL7129669 | 0.83 | BPTF (0.58) | BPTFCYP3A4KDM4EMEN1KMT2A | |
| SCHEMBL7122998 | 0.82 | BPTF (0.53) | TPMTBPTFKDM4EMEN1KMT2A | |
| SCHEMBL5779960 | 0.82 | BPTF (0.74) | TPMTBPTFCYP3A4ALDH1A1TSHR | |
| SCHEMBL401621 | 0.82 | LMNA (0.56) | TPMTCYP3A4KDM4EKMT2AMAPT | |
| SCHEMBL17655659 | 0.81 | TPMT (0.53) | TPMTCYP3A4KDM4EMEN1KMT2A |
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-109096114-B | Method for synthesizing marine natural product smenodiol | 威海海洋生物医药产业技术研究院有限公司 | 2021-02-26 | — | — | CN | claimed |
| CN-109096114-B | Method for synthesizing marine natural product smenodiol | 威海海洋生物医药产业技术研究院有限公司 | 2021-02-26 | — | — | CN | disclosed |