Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | LPO | P22079 | 2/20 | 0.50 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.50 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | TAS2R38 | P59533 | 2/20 | 0.47 |
| ▸ | MPO | P05164 | 2/20 | 0.47 |
| ▸ | TPO | P07202 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | CYB5R3 | P00387 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | ERN1 | O75460 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| Water SCHEMBL29958102 | 0.98 | SMN1; SMN2 (0.48) | SMN1; SMN2LPOPTGS1BAZ2BCYP2C19 | |
| Water SCHEMBL3285066 | 0.74 | ALDH1A1 (0.45) | ALDH1A1CYP2A6ERN1 | |
| SCHEMBL10489669 | 0.67 | LPO (0.55) | SMN1; SMN2LPOPTGS1BAZ2BCYP2C19 | |
| SCHEMBL1557716 | 0.67 | — | — | |
| SCHEMBL11678739 | 0.67 | — | — | |
| SCHEMBL11736370 | 0.67 | — | — | |
| SCHEMBL14941726 | 0.67 | — | — | |
| Methylthiouracil SCHEMBL159989 | 0.67 | — | — | |
| Methylthiouracil SCHEMBL5798462 | 0.65 | SMN1; SMN2 (0.95) | SMN1; SMN2LPOPTGS1BAZ2BCYP2C19 | |
| Propylthiouracil SCHEMBL5493716 | 0.64 | LPO (1.00) | SMN1; SMN2LPOPTGS1BAZ2BCYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |