Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 2/20 | 0.37 |
| ▸ | SRD5A1 | P18405 | 11/20 | 0.36 |
| ▸ | ESR1 | P03372 | 5/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 5/20 | 0.34 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.34 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.34 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.34 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL23891554 | 0.84 | ADRA2A (0.38) | ESR1ESR2 | |
| SCHEMBL1530577 | 0.83 | BACE1 (0.35) | KDM1AESR1ESR2 | |
| SCHEMBL9364462 | 0.83 | ADRA2A (0.43) | KDM1A | |
| SCHEMBL3900065 | 0.82 | KDM1A (0.43) | KDM1AKEAP1NFE2L2 | |
| SCHEMBL7973198 | 0.80 | KDM1A (0.36) | KDM1A | |
| SCHEMBL17605796 | 0.76 | ALDH1A1 (0.41) | — | |
| SCHEMBL23997717 | 0.76 | SIGMAR1 (0.32) | — | |
| SCHEMBL17236222 | 0.76 | KDM4E (0.32) | — | |
| SCHEMBL11170633 | 0.76 | MAP3K14 (0.39) | — | |
| SCHEMBL3020640 | 0.76 | KDM1A (0.36) | KDM1AESR1ESR2 |
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-2001045704-A1 | INHIBITORS OF PRENYL-PROTEIN TRANSFERASE | MERCK & CO., INC. (US) | 2001-06-28 | — | — | WO | disclosed |