Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 2/20 | 0.35 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.35 |
| ▸ | BACE1 | P56817 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | SCN1A | P35498 | 1/20 | 0.34 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.34 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.34 |
| ▸ | CASR | P41180 | 4/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.34 |
| ▸ | CTSD | P07339 | 2/20 | 0.34 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.34 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.33 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.32 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.32 |
| ▸ | ADRB3 | P13945 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5222603 | 1.00 | OPRM1 (0.35) | OPRM1OPRD1OPRK1BACE1CYP2D6 | |
| SCHEMBL5219393 | 0.88 | CASR (0.41) | OPRM1OPRD1OPRK1BACE1CYP2D6 | |
| SCHEMBL5219382 | 0.88 | CASR (0.41) | OPRM1OPRD1OPRK1BACE1CYP2D6 | |
| SCHEMBL5220211 | 0.86 | BACE1 (0.44) | OPRM1OPRD1OPRK1BACE1CYP2D6 | |
| SCHEMBL5220215 | 0.86 | BACE1 (0.44) | OPRM1OPRD1OPRK1BACE1CYP2D6 | |
| SCHEMBL5217991 | 0.83 | CASR (0.41) | OPRM1OPRD1OPRK1BACE1CYP2D6 | |
| SCHEMBL5223500 | 0.82 | OPRM1 (0.40) | OPRM1OPRD1OPRK1BACE1CASR | |
| SCHEMBL5223492 | 0.82 | OPRM1 (0.40) | OPRM1OPRD1OPRK1BACE1CASR | |
| SCHEMBL5219338 | 0.80 | CSNK1E (0.40) | CASR | |
| SCHEMBL5216463 | 0.77 | BACE1 (0.43) | OPRM1OPRD1OPRK1BACE1CASR |
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 |
|---|---|---|---|---|---|---|---|
| EP-1567488-B1 | HYDROXYETHYLAMINE DERIVATIVES FOR THE TREATMENT OF ALZHEIMER'S DISEASE | GLAXO GROUP LTD (GB) | 2007-02-21 | — | — | EP | disclosed |