Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 5/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7596481 | 0.91 | SLC6A4 (0.36) | HSD17B10ALDH1A1MAPTKMT2AOPRM1 | |
| SCHEMBL7597646 | 0.75 | ALDH1A1 (0.38) | HSD17B10ALDH1A1MAPTHPGDALOX15 | |
| SCHEMBL7609208 | 0.74 | KMT2A (0.43) | KMT2ASLC6A4SLC6A2SLC6A3 | |
| SCHEMBL7596854 | 0.72 | ALDH1A1 (0.36) | HSD17B10ALDH1A1MAPTHPGDNPSR1 | |
| SCHEMBL7593413 | 0.70 | ALDH1A1 (0.41) | HSD17B10ALDH1A1MAPTHPGDALOX15 | |
| SCHEMBL28660867 | 0.64 | ALDH1A1 (0.42) | HSD17B10ALDH1A1MAPTHPGDALOX15 | |
| SCHEMBL28249129 | 0.64 | ALDH1A1 (0.59) | HSD17B10ALDH1A1MAPTHPGDALOX15 | |
| SCHEMBL28768033 | 0.62 | OPRM1 (0.49) | HSD17B10ALDH1A1MAPTHPGDALOX15 | |
| SCHEMBL7613074 | 0.62 | KMT2A (0.56) | ALDH1A1MAPTKMT2AOPRM1GRIN2B | |
| SCHEMBL10581361 | 0.61 | PIN1 (0.46) | HSD17B10MAPTKMT2ASLC6A4CYP3A4 |
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 |