Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.31 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.31 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.30 |
| ▸ | CYP1B1 | Q16678 | 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 | |
|---|---|---|---|---|
| SCHEMBL24277624 | 0.92 | KDM4E (0.34) | KDM4EMAPK1ATMCYP1A1 | |
| SCHEMBL24277355 | 0.89 | ESR1 (0.38) | ESR1ESR2KDM4EMAPK1ATM | |
| SCHEMBL24277710 | 0.89 | ESR1 (0.31) | ESR1ESR2KDM4EMAPK1ATM | |
| SCHEMBL24277688 | 0.89 | KDM4E (0.38) | KDM4EMAPK1ATM | |
| SCHEMBL24277678 | 0.88 | CA12 (0.37) | ESR1ESR2KDM4EMAPK1ATM | |
| SCHEMBL24277334 | 0.87 | KDM4E (0.38) | KDM4EMAPK1ATM | |
| SCHEMBL24277708 | 0.87 | ESR1 (0.36) | ESR1ESR2KDM4EMAPK1ATM | |
| SCHEMBL24277622 | 0.87 | ESR1 (0.36) | ESR1ESR2KDM4EMAPK1ATM | |
| SCHEMBL24277630 | 0.87 | HSD17B1 (0.38) | ESR1ESR2KDM4EMAPK1ATM | |
| SCHEMBL18563220 | 0.87 | SIGMAR1 (0.33) | CYP1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022050533-A1 | NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2022-03-10 | — | — | WO | disclosed |