Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.35 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
| ▸ | PDK1 | Q15118 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL21983728 | 0.86 | CYP11B2 (0.38) | CYP11B2HDAC9 | |
| SCHEMBL9538975 | 0.85 | HDAC9 (0.41) | CYP11B2LIMK1HDAC9CES1PDK1 | |
| SCHEMBL19059299 | 0.82 | CYP11B2 (0.36) | CYP11B2HDAC9 | |
| SCHEMBL16461043 | 0.79 | HDAC9 (0.32) | CYP11B2HDAC9 | |
| SCHEMBL19059295 | 0.79 | CYP11B2 (0.36) | CYP11B2HDAC9 | |
| SCHEMBL19059004 | 0.77 | HDAC9 (0.36) | CYP11B2HDAC9 | |
| SCHEMBL15492413 | 0.75 | CYP11B2 (0.36) | CYP11B2HDAC9 | |
| SCHEMBL15492457 | 0.74 | CYP11B2 (0.36) | CYP11B2HDAC9 | |
| SCHEMBL9770510 | 0.73 | DRD2 (0.33) | LIMK1CNR2CES1PDK1 | |
| SCHEMBL16984843 | 0.73 | CYP11B2 (0.33) | CYP11B2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2693882-B1 | SUBSTITUTED CYCLOPROPYL COMPOUNDS, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF TREATMENT | MERCK SHARP & DOHME (US) | 2017-06-28 | — | — | EP | disclosed |