Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.54 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.54 |
| ▸ | SHBG | P04278 | 1/20 | 0.46 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.38 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.38 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.38 |
| ▸ | DAO | P14920 | 1/20 | 0.37 |
| ▸ | IDH1 | O75874 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | SRC | P12931 | 1/20 | 0.36 |
| ▸ | PRKACA | P17612 | 1/20 | 0.36 |
| ▸ | PRKACG | P22612 | 1/20 | 0.36 |
| ▸ | PRKACB | P22694 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4063169 | 0.87 | ESR1 (0.71) | ESR1ESR2SHBGAMY1ATP53 | |
| SCHEMBL29636483 | 0.87 | ESR1 (0.71) | ESR1ESR2SHBGAMY1ATP53 | |
| SCHEMBL3187895 | 0.87 | ESR1 (0.71) | ESR1ESR2SHBGAMY1ATP53 | |
| SCHEMBL4055517 | 0.87 | ESR1 (0.71) | ESR1ESR2SHBGAMY1ATP53 | |
| SCHEMBL4065316 | 0.86 | ESR1 (0.59) | ESR1ESR2SHBGAMY1ATP53 | |
| SCHEMBL8351876 | 0.85 | ESR1 (0.69) | ESR1ESR2SHBGAMY1ATP53 | |
| SCHEMBL21096818 | 0.85 | ESR1 (0.74) | ESR1ESR2TP53TDP1DAO | |
| SCHEMBL14395905 | 0.82 | ESR1 (0.63) | ESR1ESR2SHBGAMY1ATP53 | |
| SCHEMBL30783352 | 0.82 | ESR1 (0.74) | ESR1ESR2SHBGAMY1ATP53 | |
| SCHEMBL6846484 | 0.82 | ESR1 (0.74) | ESR1ESR2SHBGAMY1ATP53 |
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-3686252-A1 | RADIATION CURABLE INKJET INK FOR MANUFACTURING PRINTED CIRCUIT BOARDS | AGFA-GEVAERT NV (BE) | 2020-07-29 | — | — | EP | disclosed |