Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 2/20 | 0.40 |
| ▸ | KDM1A | O60341 | 12/20 | 0.33 |
| ▸ | MAOA | P21397 | 11/20 | 0.33 |
| ▸ | MAOB | P27338 | 11/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | CYP17A1 | P05093 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10020901 | 0.76 | TACR1 (0.40) | TACR1KDM1AMAOAMAOBTRPA1 | |
| SCHEMBL23646349 | 0.70 | KDM1A (0.40) | KDM1AMAOAMAOBTRPA1CYP17A1 | |
| SCHEMBL5555080 | 0.69 | ALOX15 (0.32) | — | |
| SCHEMBL14062178 | 0.69 | KDM1A (0.39) | KDM1AMAOAMAOB | |
| SCHEMBL2692113 | 0.66 | G6PD (0.30) | — | |
| SCHEMBL21611368 | 0.66 | KDM1A (0.41) | KDM1AMAOAMAOB | |
| SCHEMBL8675407 | 0.63 | TSHR (0.48) | KDM1AMAOAMAOB | |
| SCHEMBL8674396 | 0.63 | TSHR (0.48) | KDM1AMAOAMAOB | |
| SCHEMBL1265907 | 0.63 | TSHR (0.48) | KDM1AMAOAMAOB | |
| SCHEMBL1265905 | 0.63 | TSHR (0.48) | KDM1AMAOAMAOB |
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-0757669-A1 | O-ACYL-4-PHENYL-CYCLOHEXANOLS, THEIR SALTS, MEDICAMENTS CONTAINING SUCH COMPOUNDS AND THEIR USE, AS WELL AS A METHOD OF PREPARING THEM | Dr. Karl Thomae GmbH (DE) | 1997-02-12 | — | — | EP | disclosed |
| WO-1995029148-A1 | O-ACYL-4-PHENYL-CYCLOHEXANOLS, THEIR SALTS, MEDICAMENTS CONTAINING SUCH COMPOUNDS AND THEIR USE, AS WELL AS A METHOD OF PREPARING THEM | DR. KARL THOMAE GMBH (DE) | 1995-11-02 | — | — | WO | disclosed |