Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.30 |
| ▸ | ACE | P12821 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | CNR2 | P34972 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7597111 | 0.89 | KMT2A (0.45) | KMT2AALDH1A1MAPTRXFP1TSHR | |
| SCHEMBL3304551 | 0.72 | ALDH1A1 (0.47) | KMT2AALDH1A1CYP1A2 | |
| SCHEMBL7120249 | 0.64 | KMT2A (0.52) | KMT2AALDH1A1MAPTSMN1; SMN2HTT | |
| SCHEMBL7519445 | 0.64 | KMT2A (0.60) | KMT2AALDH1A1MAPTAKR1C3CYP2C19 | |
| SCHEMBL7613074 | 0.64 | KMT2A (0.56) | KMT2AALDH1A1MAPTCYP2C19 | |
| SCHEMBL23480476 | 0.64 | KMT2A (0.49) | KMT2AALDH1A1MAPTTSHRCYP1A2 | |
| SCHEMBL7595087 | 0.64 | CNR2 (0.38) | KMT2AALDH1A1MAPTTSHRSMN1; SMN2 | |
| SCHEMBL5964811 | 0.63 | ALDH1A1 (0.35) | ALDH1A1MAPTCYP1A2 | |
| Hydrochloric Acid SCHEMBL9789713 | 0.63 | KMT2A (0.48) | KMT2AALDH1A1MAPTTSHRCYP1A2 | |
| SCHEMBL7979855 | 0.63 | KMT2A (0.48) | KMT2AALDH1A1MAPTTSHRCYP1A2 |
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 |