Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.31 |
| ▸ | WNT1 | P04628 | 2/20 | 0.30 |
| ▸ | GSK3B | P49841 | 2/20 | 0.30 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
| ▸ | MCHR1 | Q99705 | 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 | |
|---|---|---|---|---|
| SCHEMBL14207964 | 0.82 | ESR1 (0.37) | ESR1ESR2TLR7WNT1GSK3B | |
| SCHEMBL23975685 | 0.82 | ESR1 (0.37) | ESR1ESR2TLR7WNT1GSK3B | |
| SCHEMBL12714681 | 0.79 | KIF11 (0.32) | ESR1ESR2WNT1GSK3BDYRK1A | |
| SCHEMBL23775665 | 0.79 | KIF11 (0.32) | ESR1ESR2WNT1GSK3BDYRK1A | |
| SCHEMBL24702302 | 0.78 | ESR1 (0.35) | ESR1ESR2 | |
| SCHEMBL24702322 | 0.78 | ESR1 (0.35) | ESR1ESR2 | |
| SCHEMBL26512216 | 0.78 | ESR1 (0.35) | ESR1ESR2TLR7WNT1GSK3B | |
| SCHEMBL25367185 | 0.78 | ESR1 (0.34) | ESR1ESR2TLR7 | |
| SCHEMBL25365358 | 0.78 | ESR1 (0.34) | ESR1ESR2TLR7 | |
| SCHEMBL23206538 | 0.76 | ESR1 (0.34) | ESR1ESR2TLR7 |
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-2023086383-A1 | SELECT KRAS G12C INHIBITORS AND USES THEREOF | 1200 PHARMA LLC (US) | 2023-05-19 | — | — | WO | disclosed |