Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 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 | |
|---|---|---|---|---|
| SCHEMBL20846254 | 1.00 | TSHR (0.38) | TSHRKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL4065666 | 1.00 | TSHR (0.38) | TSHRKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL13511 | 0.97 | — | — | |
| SCHEMBL2778228 | 0.92 | — | — | |
| SCHEMBL30927784 | 0.76 | PNMT (0.37) | TSHRKDM4E | |
| SCHEMBL30927783 | 0.76 | PNMT (0.37) | TSHRKDM4E | |
| SCHEMBL30927785 | 0.76 | PNMT (0.37) | TSHRKDM4E | |
| SCHEMBL4288823 | 0.73 | HTR2C (0.48) | — | |
| SCHEMBL11826056 | 0.73 | PNMT (0.39) | — | |
| SCHEMBL4878353 | 0.73 | PNMT (0.42) | KDM4E |
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-2025045233-A1 | MACROCYCLIC COMPOUNDS, PREPARATION METHOD THEREFOR, AND USE THEREOF | 劲方医药科技(上海)股份有限公司 | 2025-03-06 | — | — | WO | disclosed |