Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RYR2 | Q92736 | 7/20 | 0.62 |
| ▸ | ESR1 | P03372 | 1/20 | 0.56 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.56 |
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
| ▸ | CA2 | P00918 | 1/20 | 0.52 |
| ▸ | CA7 | P43166 | 1/20 | 0.52 |
| ▸ | CA9 | Q16790 | 1/20 | 0.52 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | ABHD6 | Q9BV23 | 1/20 | 0.50 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.50 |
| ▸ | NAMPT | P43490 | 3/20 | 0.48 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.47 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.47 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.47 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.46 |
| ▸ | TMPRSS2 | O15393 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL15880544 | 0.85 | ESR1 (0.57) | RYR2ESR1ESR2CA1CA2 | |
| SCHEMBL30677763 | 0.85 | ESR1 (0.57) | RYR2ESR1ESR2CA1CA2 | |
| SCHEMBL14590586 | 0.85 | ESR1 (0.57) | RYR2ESR1ESR2CA1CA2 | |
| SCHEMBL16282723 | 0.81 | ESR1 (0.60) | RYR2ESR1ESR2CA1CA2 | |
| SCHEMBL15989340 | 0.81 | ESR1 (0.53) | RYR2ESR1ESR2CA1CA2 | |
| SCHEMBL17341937 | 0.81 | NAMPT (0.53) | RYR2ESR1ESR2CA1CA2 | |
| SCHEMBL25825941 | 0.80 | ESR1 (0.80) | RYR2ESR1ESR2CA1CA2 | |
| SCHEMBL30685013 | 0.80 | ESR1 (0.52) | RYR2ESR1ESR2CA1CA2 | |
| SCHEMBL24761144 | 0.78 | ESR2 (0.56) | ESR1ESR2CA1CA2CA7 | |
| SCHEMBL6234508 | 0.78 | ESR1 (0.51) | RYR2ESR1ESR2CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109843379-B | Substituted ureas and methods of making and using the same | 梅比斯发现公司 | 2022-12-30 | — | — | CN | disclosed |