Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 5/20 | 0.33 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 2/20 | 0.33 |
| ▸ | ESR1 | P03372 | 2/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL19738679 | 0.89 | CNR2 (0.40) | CNR2CNR1ESR1ESR2 | |
| SCHEMBL22023780 | 0.87 | CNR2 (0.45) | CNR2CNR1 | |
| SCHEMBL19738629 | 0.85 | CNR2 (0.47) | CNR2CNR1 | |
| SCHEMBL22328432 | 0.83 | NPC1 (0.36) | CNR2LOXL2 | |
| SCHEMBL25490213 | 0.82 | KIF11 (0.35) | LOXL2 | |
| SCHEMBL22365169 | 0.79 | ESR1 (0.32) | CNR2CNR1ESR1ESR2 | |
| SCHEMBL19738659 | 0.78 | ESR1 (0.33) | CNR2CNR1ESR1ESR2 | |
| SCHEMBL15885025 | 0.78 | CCNA2 (0.36) | CNR2LOXL2CNR1 | |
| SCHEMBL19738148 | 0.77 | ESR1 (0.35) | CNR2LOXL2CNR1ESR1ESR2 | |
| SCHEMBL18470613 | 0.77 | KIF11 (0.40) | CNR2CNR1ESR1ESR2 |
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 |
|---|---|---|---|---|---|---|---|
| US-9732083-B2 | Tricyclic gyrase inhibitors | MERCK SHARP & DOHME CORP. (US) | 2017-08-15 | — | — | US | disclosed |