Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.33 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.32 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.32 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.31 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.31 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.31 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.31 |
| ▸ | BACE1 | P56817 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 1/20 | 0.30 |
| ▸ | ALOX5 | P09917 | 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 | |
|---|---|---|---|---|
| SCHEMBL19393437 | 0.88 | HSD17B1 (0.36) | ESR1ESR2HSD17B1HSD17B2CYP17A1 | |
| SCHEMBL25773583 | 0.86 | ESR1 (0.32) | ESR1ESR2HSD17B1HSD17B2 | |
| SCHEMBL22130790 | 0.85 | HSD17B1 (0.33) | ESR1ESR2HSD17B1HSD17B2ALOX5 | |
| SCHEMBL25012697 | 0.85 | — | — | |
| SCHEMBL18730462 | 0.84 | ALDH1A1 (0.32) | ESR1ESR2ALOX5 | |
| SCHEMBL23341400 | 0.84 | — | — | |
| SCHEMBL19797528 | 0.82 | GSTP1 (0.32) | GSTP1 | |
| SCHEMBL23241387 | 0.81 | KDM4E (0.32) | — | |
| SCHEMBL22061016 | 0.81 | KDM4E (0.32) | — | |
| SCHEMBL22130773 | 0.81 | KMO (0.33) | ESR1 |
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-4129972-A1 | COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE | Idemitsu Kosan Co.,Ltd. (JP) | 2023-02-08 | — | — | EP | disclosed |