Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 5/20 | 0.39 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.37 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.37 |
| ▸ | ADRB3 | P13945 | 3/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | GPR139 | Q6DWJ6 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | USP5 | P45974 | 1/20 | 0.34 |
| ▸ | PTPRC | P08575 | 2/20 | 0.34 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.34 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.34 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.34 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6540660 | 0.91 | BACE1 (0.40) | BACE1ADRB3ADRB2ADRB1IDO1 | |
| SCHEMBL6540666 | 0.91 | BACE1 (0.40) | BACE1ADRB3ADRB2ADRB1IDO1 | |
| SCHEMBL6541213 | 0.86 | BACE1 (0.39) | BACE1ADRB3ADRB2ADRB1CA1 | |
| SCHEMBL6541210 | 0.86 | BACE1 (0.39) | BACE1ADRB3ADRB2ADRB1CA1 | |
| SCHEMBL6541176 | 0.80 | ADRB3 (0.46) | BACE1ADRB3ADRB2ADRB1MEN1 | |
| SCHEMBL6541170 | 0.80 | ADRB3 (0.46) | BACE1ADRB3ADRB2ADRB1MEN1 | |
| SCHEMBL6540640 | 0.80 | ADRB3 (0.41) | BACE1ADRB3ADRB2ADRB1GPR139 | |
| SCHEMBL6540645 | 0.80 | ADRB3 (0.41) | BACE1ADRB3ADRB2ADRB1GPR139 | |
| SCHEMBL6540346 | 0.79 | BACE1 (0.38) | BACE1ADRB3ADRB2ADRB1 | |
| SCHEMBL6540342 | 0.79 | BACE1 (0.38) | BACE1ADRB3ADRB2ADRB1 |
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-1389185-A2 | AMINOALCOHOL DERIVATIVES | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2004-02-18 | — | — | EP | disclosed |
| WO-2002094770-A2 | AMINOALCOHOL DERIVATIVES | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2002-11-28 | — | — | WO | disclosed |