Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 2/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.45 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL396501 | 0.86 | IDO1 (0.50) | KMT2AMEN1ALDH1A1NFE2L2MAPT | |
| SCHEMBL2341243 | 0.83 | ABCB1 (0.50) | ABCB1RXFP1KMT2AMEN1ALDH1A1 | |
| SCHEMBL13034146 | 0.81 | RXFP1 (0.49) | ABCB1RXFP1KMT2AMEN1ALDH1A1 | |
| SCHEMBL28769967 | 0.80 | KMT2A (0.50) | ABCB1RXFP1KMT2AMEN1ALDH1A1 | |
| SCHEMBL19973036 | 0.80 | RXFP1 (0.48) | ABCB1RXFP1KMT2AMEN1ALDH1A1 | |
| SCHEMBL15910968 | 0.78 | THRB (0.56) | ALDH1A1GAANFE2L2LMNAMAPT | |
| SCHEMBL29577996 | 0.77 | THRB (0.53) | ALDH1A1LMNASMN1; SMN2HIF1A | |
| SCHEMBL10451653 | 0.77 | THRB (0.53) | ALDH1A1LMNASMN1; SMN2HIF1A | |
| SCHEMBL6849251 | 0.77 | THRB (0.41) | ALDH1A1HIF1A | |
| SCHEMBL490497 | 0.77 | KMT2A (0.47) | ABCB1RXFP1KMT2AMEN1ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0690054-B1 | 1-Amino-2-cyclohexene derivatives and production process therefor | KURARAY CO (JP) | 2002-11-20 | — | — | EP | disclosed |
| US-5587486-A | CONDENSATION; CARBONYLATION; HYDROLYSIS; INTERMEDIATES IN THE PRODUCTION OF MEDICINAL AND AGRICULTURAL AGENTS | KURARAY CO., LTD. (JP) | 1996-12-24 | — | — | US | disclosed |
| EP-0690054-A1 | 1-Amino-2-cyclohexene derivatives and production process therefor | KURARAY CO., LTD. (JP) | 1996-01-03 | — | — | EP | disclosed |