Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL30157378 | 0.77 | HSD17B10 (0.51) | HSD17B10SRD5A2KDM4EALDH1A1HPGD | |
| SCHEMBL4846616 | 0.68 | HSD17B10 (0.53) | HSD17B10SRD5A2KDM4EALDH1A1HPGD | |
| SCHEMBL9449413 | 0.62 | PPARG (0.54) | HSD17B10SRD5A2KDM4EALDH1A1HPGD | |
| SCHEMBL28871852 | 0.59 | HSD17B10 (0.69) | HSD17B10KDM4EALDH1A1HPGDSOS1 | |
| SCHEMBL11110095 | 0.59 | ALDH1A1 (0.39) | HSD17B10KDM4EALDH1A1HPGDCYP3A4 | |
| SCHEMBL17498196 | 0.59 | KDM4E (0.33) | HSD17B10KDM4EALDH1A1HPGD | |
| Fluorene SCHEMBL4852000 | 0.58 | ALDH1A1 (0.55) | HSD17B10SRD5A2KDM4EALDH1A1HPGD | |
| SCHEMBL4764761 | 0.58 | ALDH1A1 (0.49) | HSD17B10KDM4EALDH1A1HPGDCYP3A4 | |
| SCHEMBL6545915 | 0.58 | ALDH1A1 (0.44) | HSD17B10KDM4EALDH1A1HPGDCYP3A4 | |
| Hydrochloric Acid SCHEMBL17498097 | 0.58 | KDM4E (0.33) | HSD17B10KDM4EALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023001123-A1 | NEW PYRIDOPYRIMIDINE DERIVATIVE | 上海艾力斯医药科技股份有限公司 | 2023-01-26 | — | — | WO | disclosed |