Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | ARG1 | P05089 | 1/20 | 0.32 |
| ▸ | ARG2 | P78540 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28562769 | 0.80 | CA1 (0.33) | — | |
| Diethylaminoethanol SCHEMBL11112827 | 0.77 | CYP1A2 (0.39) | CYP1A2CYP2C9HPGDMAPK1HIF1A | |
| SCHEMBL28570749 | 0.76 | MAPT (0.35) | MAPT | |
| SCHEMBL7103711 | 0.75 | MAPT (0.35) | CYP1A2CYP2C9HPGDMAPK1HIF1A | |
| SCHEMBL28559197 | 0.74 | — | — | |
| SCHEMBL21618434 | 0.73 | MAPT (0.33) | CYP1A2CYP2C9HPGDMAPK1HIF1A | |
| Trolamine SCHEMBL2889481 | 0.73 | HPGD (0.34) | CYP1A2CYP2C9HPGDMAPK1HIF1A | |
| Trolamine SCHEMBL11408606 | 0.73 | MAPT (0.47) | CYP1A2CYP2C9HPGDMAPK1HIF1A | |
| SCHEMBL27526999 | 0.71 | MAPT (0.32) | HPGDMAPK1MAPT | |
| Trolamine SCHEMBL28484146 | 0.70 | MAPT (0.44) | CYP1A2CYP2C9HPGDMAPK1HIF1A |
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-0927174-A1 | NEW AMINO ALCOHOL DERIVATIVES, PROCESS FOR THE PRODUCTION THEREOF AND MEDICAMENTS AND REAGENTS CONTAINING THESE COMPOUNDS | MediGene Oncology GmbH (DE) | 1999-07-07 | — | — | EP | disclosed |
| WO-1998011082-A1 | NEW AMINO ALCOHOL DERIVATIVES, PROCESS FOR THE PRODUCTION THEREOF AND MEDICAMENTS AND REAGENTS CONTAINING THESE COMPOUNDS | ROCHE DIAGNOSTICS GMBH (DE) | 1998-03-19 | — | — | WO | disclosed |