Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK2 | O96017 | 1/20 | 0.43 |
| ▸ | LTA4H | P09960 | 5/20 | 0.39 |
| ▸ | CNR2 | P34972 | 2/20 | 0.38 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
| ▸ | NQO2 | P16083 | 1/20 | 0.37 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.37 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.37 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.37 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.37 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6192190 | 0.87 | CHEK2 (0.43) | CHEK2ESR1ESR2NQO2 | |
| SCHEMBL6003394 | 0.85 | CHEK2 (0.43) | CHEK2LTA4HAURKBESR1ESR2 | |
| SCHEMBL6003300 | 0.84 | CHEK2 (0.43) | CHEK2LTA4HAURKBESR1ESR2 | |
| SCHEMBL6003307 | 0.84 | CHEK2 (0.43) | CHEK2LTA4HAURKBESR1ESR2 | |
| SCHEMBL5706403 | 0.84 | CHEK2 (0.48) | CHEK2LTA4HAURKBESR1ESR2 | |
| SCHEMBL5706380 | 0.84 | CHEK2 (0.48) | CHEK2LTA4HAURKBESR1ESR2 | |
| SCHEMBL6005363 | 0.83 | CHEK2 (0.42) | CHEK2LTA4HAURKBESR1ESR2 | |
| SCHEMBL6152202 | 0.83 | LTA4H (0.39) | CHEK2LTA4HAURKB | |
| SCHEMBL6005756 | 0.83 | CHEK2 (0.47) | CHEK2LTA4HAURKBESR1ESR2 | |
| SCHEMBL6003358 | 0.83 | CHEK2 (0.43) | CHEK2LTA4HAURKBESR1ESR2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1546139-A1 | DERIVATIVE OF DIHYDRO-DIBENZO (A) ANTHRACENES AND THEIR USE AS SELECTIVE ESTROGEN RECEPTOR MODULATORS | ELI LILLY AND COMPANY (US) | 2005-06-29 | — | — | EP | disclosed |
| WO-2004029047-A1 | DERIVATIVE OF DIHYDRO-DIBENZO (A) ANTHRACENES AND THEIR USE AS SELECTIVE ESTROGEN RECEPTOR MODULATORS | ELI LILLY AND COMPANY (US) | 2004-04-08 | — | — | WO | disclosed |