Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.37 |
| ▸ | ELANE | P08246 | 4/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | PLCG1 | P19174 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29145521 | 0.83 | KDM4E (0.45) | KDM4EALDH1A1SSTR4RECQLNOTUM | |
| SCHEMBL29145515 | 0.78 | PLCG1 (0.44) | KDM4EALDH1A1SSTR4RECQLNOTUM | |
| SCHEMBL1291219 | 0.78 | ELANE (0.44) | KDM4EALDH1A1SSTR4RECQLELANE | |
| SCHEMBL3834658 | 0.77 | KDM4E (0.44) | KDM4EALDH1A1SSTR4RECQLNOTUM | |
| SCHEMBL21708412 | 0.76 | ALDH1A1 (0.37) | ALDH1A1GAASMN1; SMN2 | |
| SCHEMBL27712540 | 0.76 | LMNA (0.48) | KDM4EALDH1A1SSTR4SLC22A12ELANE | |
| SCHEMBL15303617 | 0.75 | KDM4E (0.50) | KDM4EALDH1A1SSTR4SLC22A12NOTUM | |
| SCHEMBL1280798 | 0.73 | SSTR4 (0.43) | KDM4EALDH1A1SSTR4RECQLNOTUM | |
| SCHEMBL29145518 | 0.72 | SSTR4 (0.46) | KDM4EALDH1A1SSTR4SLC22A12NOTUM | |
| SCHEMBL9764073 | 0.71 | NPC1 (0.46) | KDM4EALDH1A1GAASMN1; SMN2HPGD |
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-115403584-B | 2-thio-2, 3-dihydropyrimidine-4-one derivatives, pharmaceutical compositions, preparation methods and applications thereof | 长春金赛药业有限责任公司 | 2024-04-02 | — | — | CN | disclosed |
| CN-115403584-A | 2-thio-2, 3-dihydropyrimidine-4-one derivative, pharmaceutical composition, preparation method and application thereof | 长春金赛药业有限责任公司 | 2022-11-29 | — | — | CN | disclosed |