Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VDR | P11473 | 2/20 | 0.54 |
| ▸ | USP2 | O75604 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.49 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.49 |
| ▸ | POLA1 | P09884 | 1/20 | 0.49 |
| ▸ | TOP2A | P11388 | 1/20 | 0.49 |
| ▸ | TOP2B | Q02880 | 1/20 | 0.49 |
| ▸ | NPC1L1 | Q9UHC9 | 2/20 | 0.46 |
| ▸ | FNTA | P49354 | 1/20 | 0.44 |
| ▸ | FNTB | P49356 | 1/20 | 0.44 |
| ▸ | CDC25A | P30304 | 1/20 | 0.44 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL25334704 | 1.00 | VDR (0.54) | VDRUSP2CYP2C9HIF1AGPBAR1 | |
| SCHEMBL21561555 | 0.95 | VDR (0.58) | VDRUSP2CYP2C9HIF1AGPBAR1 | |
| SCHEMBL11786452 | 0.89 | NPC1L1 (0.58) | VDRUSP2POLA1TOP2ATOP2B | |
| SCHEMBL11786454 | 0.89 | NPC1L1 (0.58) | VDRUSP2POLA1TOP2ATOP2B | |
| SCHEMBL6393234 | 0.89 | NPC1L1 (0.56) | VDRUSP2POLA1TOP2ATOP2B | |
| SCHEMBL11788002 | 0.89 | NPC1L1 (0.56) | VDRUSP2POLA1TOP2ATOP2B | |
| SCHEMBL25337296 | 0.86 | NPC1L1 (0.64) | VDRUSP2CYP2C9HIF1AGPBAR1 | |
| SCHEMBL11786843 | 0.85 | USP2 (0.51) | VDRUSP2POLA1TOP2ATOP2B | |
| SCHEMBL11786829 | 0.85 | USP2 (0.51) | VDRUSP2POLA1TOP2ATOP2B | |
| SCHEMBL25336776 | 0.85 | NPC1L1 (0.53) | VDRUSP2CYP2C9HIF1AGPBAR1 |
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-2023143399-A1 | STEROID COMPOUND, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | 珂阑(上海)医药科技有限公司 | 2023-08-03 | — | — | WO | disclosed |