Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 10/20 | 0.38 |
| ▸ | ADRB2 | P07550 | 9/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.37 |
| ▸ | HTR7 | P34969 | 3/20 | 0.37 |
| ▸ | HTR1A | P08908 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4478639 | 0.94 | CHRM3 (0.41) | EPHX2CHRM3ADRB2TSHRMAPK1 | |
| SCHEMBL4494233 | 0.91 | CHRM3 (0.41) | CHRM3ADRB2TSHRMAPK1HTR7 | |
| SCHEMBL4490817 | 0.89 | CHRM3 (0.41) | EPHX2CHRM3ADRB2HTR7HTR1A | |
| SCHEMBL4493215 | 0.88 | CHRM3 (0.42) | EPHX2CHRM3ADRB2 | |
| SCHEMBL4483286 | 0.88 | CHRM3 (0.42) | EPHX2CHRM3ADRB2 | |
| SCHEMBL265402 | 0.87 | CHRM3 (0.49) | CHRM3ADRB2 | |
| SCHEMBL4470548 | 0.86 | ATR (0.44) | EPHX2CHRM3ADRB2HTR7HTR1A | |
| SCHEMBL4478702 | 0.86 | CHRM3 (0.39) | EPHX2CHRM3ADRB2HTR7HTR1A | |
| SCHEMBL4474955 | 0.86 | CHRM2 (0.40) | CHRM3ADRB2TSHRMAPK1HTR7 | |
| SCHEMBL4474416 | 0.84 | CHRM3 (0.46) | CHRM3ADRB2 |
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-7632847-B2 | Bronchodilators; treating chronic obstructive pulmonary disease or asthma; long duration of action; reduced side effects, such as dry-mouth and constipation; e.g. biphenyl-2-ylcarbamic acid 1-(2-(3-[3-(4-hydroxybenzylamino)propionylamino]benzoylamino)ethyl)piperidin-4-yl ester | THERAVANCE, INC. (US) | 2009-12-15 | — | — | US | disclosed |