Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | ESR1 | P03372 | 3/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.46 |
| ▸ | CYP46A1 | Q9Y6A2 | 2/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.40 |
| ▸ | DHODH | Q02127 | 1/20 | 0.40 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
| ▸ | ESRRA | P11474 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9246606 | 0.88 | HSD17B10 (0.62) | HSP90AB1HSD17B10ESR1ESR2HSD17B1 | |
| SCHEMBL27419836 | 0.79 | HSP90AB1 (0.51) | HSP90AB1HSD17B10ESR1ESR2HSD17B1 | |
| SCHEMBL4936169 | 0.79 | CA2 (0.50) | HSP90AB1HSD17B10ESR1ESR2 | |
| SCHEMBL9125028 | 0.78 | HSP90AB1 (0.49) | HSP90AB1HSD17B10ESR1ESR2HSD17B1 | |
| SCHEMBL1679245 | 0.77 | CYP2C19 (0.61) | HSD17B10MEN1KMT2A | |
| SCHEMBL28182687 | 0.77 | HSP90AB1 (0.42) | HSP90AB1HSD17B10ESR1ESR2HSD17B1 | |
| SCHEMBL1305878 | 0.75 | CSNK2A1 (0.62) | HSP90AB1HSD17B10CSNK2A1MEN1KMT2A | |
| SCHEMBL29368656 | 0.75 | CSNK2A1 (0.62) | HSP90AB1HSD17B10CSNK2A1MEN1KMT2A | |
| SCHEMBL9542216 | 0.75 | L3MBTL1 (0.46) | ADORA3MEN1KMT2A | |
| SCHEMBL31693367 | 0.73 | MEN1 (0.65) | HSP90AB1HSD17B10MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3087064-B1 | PRODRUGS OF UROLITIHNS AND USES THEREOF | AMAZENTIS SA (CH) | 2021-09-15 | — | — | EP | disclosed |