Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | OPRM1 | P35372 | 6/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 6/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 6/20 | 0.38 |
| ▸ | OPRL1 | P41146 | 6/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | SCN5A | Q14524 | 3/20 | 0.36 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4169139 | 0.89 | ACP3 (0.40) | ALDH1A1MAPTHPGDALOX15TSHR | |
| Hexane SCHEMBL11468774 | 0.83 | MAPT (0.35) | MAPTOPRM1OPRD1OPRK1OPRL1 | |
| SCHEMBL8170715 | 0.75 | OPRM1 (0.45) | ALDH1A1HPGDOPRM1OPRD1OPRK1 | |
| Hexane SCHEMBL11479643 | 0.74 | ALDH1A1 (0.36) | ALDH1A1HPGDOPRM1OPRK1OPRL1 | |
| SCHEMBL2554823 | 0.73 | ALDH1A1 (0.43) | ALDH1A1 | |
| SCHEMBL11469489 | 0.73 | EPHX2 (0.43) | ALDH1A1MAPTHPGDALOX15TSHR | |
| Hexane SCHEMBL11478445 | 0.73 | LMNA (0.38) | ALDH1A1HPGDKMT2A | |
| SCHEMBL7273201 | 0.72 | ERN1 (0.34) | TSHR | |
| SCHEMBL29061975 | 0.70 | HPGD (0.44) | ALDH1A1MAPTHPGDALOX15TSHR | |
| SCHEMBL954629 | 0.70 | HPGD (0.44) | ALDH1A1MAPTHPGDALOX15TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-4209621-A | TRANQUILIZERS | AMERICAN CYANAMID COMPANY (US) | 1980-06-24 | — | — | US | disclosed |