Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 16/20 | 0.62 |
| ▸ | PSMB1 | P20618 | 4/20 | 0.62 |
| ▸ | PSMB5 | P28074 | 3/20 | 0.62 |
| ▸ | PSMB2 | P49721 | 1/20 | 0.62 |
| ▸ | ESR2 | Q92731 | 8/20 | 0.57 |
| ▸ | PDE1A | P54750 | 1/20 | 0.57 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.57 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.57 |
| ▸ | CYP19A1 | P11511 | 6/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.56 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.56 |
| ▸ | ESRRG | P62508 | 3/20 | 0.56 |
| ▸ | ESRRB | O95718 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL17845169 | 1.00 | ESR1 (0.62) | ESR1PSMB1PSMB5PSMB2ESR2 | |
| SCHEMBL17858203 | 1.00 | ESR1 (0.62) | ESR1PSMB1PSMB5PSMB2ESR2 | |
| SCHEMBL17845170 | 1.00 | ESR1 (0.62) | ESR1PSMB1PSMB5PSMB2ESR2 | |
| SCHEMBL17845172 | 1.00 | ESR1 (0.62) | ESR1PSMB1PSMB5PSMB2ESR2 | |
| SCHEMBL17858206 | 0.96 | ESR1 (0.67) | ESR1PSMB1PSMB5PSMB2ESR2 | |
| SCHEMBL17845214 | 0.96 | ESR1 (0.67) | ESR1PSMB1PSMB5PSMB2ESR2 | |
| SCHEMBL17845112 | 0.96 | ESR1 (0.67) | ESR1PSMB1PSMB5PSMB2ESR2 | |
| SCHEMBL17858207 | 0.96 | ESR1 (0.67) | ESR1PSMB1PSMB5PSMB2ESR2 | |
| SCHEMBL17845113 | 0.96 | ESR1 (0.67) | ESR1PSMB1PSMB5PSMB2ESR2 | |
| SCHEMBL17845211 | 0.96 | ESR1 (0.67) | ESR1PSMB1PSMB5PSMB2ESR2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107406424-B | Estrogen receptor modulators and uses thereof | 豪夫迈·罗氏有限公司 | 2020-08-25 | — | — | CN | disclosed |
| EP-3233828-B1 | ESTROGEN RECEPTOR MODULATORS AND USES THEREOF | HOFFMANN LA ROCHE (CH) | 2020-03-04 | — | — | EP | disclosed |