Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | ADRB3 | P13945 | 11/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | NAMPT | P43490 | 1/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9934066 | 0.91 | ADRB3 (0.40) | ADRB3SLC6A4GPR119NAMPTADRB1 | |
| SCHEMBL9934063 | 0.91 | ADRB3 (0.40) | ADRB3SLC6A4GPR119NAMPTADRB1 | |
| SCHEMBL12862418 | 0.89 | GPR119 (0.39) | ADRB3SLC6A4GPR119NAMPT | |
| SCHEMBL12862385 | 0.89 | GPR119 (0.39) | ADRB3SLC6A4GPR119NAMPT | |
| SCHEMBL17986569 | 0.89 | GPR119 (0.39) | ADRB3SLC6A4GPR119NAMPT | |
| SCHEMBL9934730 | 0.88 | MAPT (0.42) | ADRB3SLC6A4MAPTALDH1A1ADRB1 | |
| SCHEMBL9934734 | 0.88 | MAPT (0.42) | ADRB3SLC6A4MAPTALDH1A1ADRB1 | |
| SCHEMBL16619092 | 0.87 | HDAC1 (0.38) | HDAC1HDAC6SLC6A4MAPTGPR119 | |
| SCHEMBL18210791 | 0.87 | HDAC1 (0.38) | HDAC1HDAC6SLC6A4MAPTGPR119 | |
| SCHEMBL17986557 | 0.87 | HDAC1 (0.38) | HDAC1HDAC6SLC6A4MAPTGPR119 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011025690-A1 | NOVEL PYRROLIDINE DERIVED BETA 3 ADRENERGIC RECEPTOR AGONISTS | MERCK SHARP & DOHME CORP. (US) | 2011-03-03 | — | — | WO | disclosed |