Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYSLTR2 | Q9NS75 | 2/20 | 0.55 |
| ▸ | CYSLTR1 | Q9Y271 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | RECQL | P46063 | 1/20 | 0.54 |
| ▸ | BLM | P54132 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.54 |
| ▸ | EGFR | P00533 | 1/20 | 0.54 |
| ▸ | ESR1 | P03372 | 1/20 | 0.54 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.54 |
| ▸ | FYN | P06241 | 1/20 | 0.54 |
| ▸ | PGR | P06401 | 1/20 | 0.54 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.54 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.54 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.54 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.54 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.54 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.54 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.54 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL9689591 | 0.89 | CYSLTR2 (0.56) | CYSLTR2CYSLTR1MEN1RECQLBLM | |
| SCHEMBL9689041 | 0.89 | CYSLTR2 (0.53) | CYSLTR2CYSLTR1 | |
| SCHEMBL9688179 | 0.87 | — | — | |
| SCHEMBL8931783 | 0.86 | CYSLTR1 (0.73) | CYSLTR2CYSLTR1MEN1RECQLBLM | |
| SCHEMBL10054296 | 0.86 | CYSLTR1 (0.73) | CYSLTR2CYSLTR1MEN1RECQLBLM | |
| Acetic Acid SCHEMBL4252301 | 0.86 | CYSLTR2 (0.54) | CYSLTR2CYSLTR1MEN1RECQLBLM | |
| SCHEMBL9689399 | 0.86 | CYSLTR2 (0.52) | CYSLTR2CYSLTR1 | |
| SCHEMBL9225365 | 0.84 | CYP2C8 (0.54) | CYSLTR2CYSLTR1CYP2C8 | |
| SCHEMBL24936748 | 0.84 | CYSLTR1 (0.76) | CYSLTR2CYSLTR1MEN1RECQLBLM | |
| SCHEMBL8496455 | 0.84 | CYSLTR1 (0.76) | CYSLTR2CYSLTR1MEN1RECQLBLM |
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 |
|---|---|---|---|---|---|---|---|
| US-5428033-A | Useful as anti-asthmatic, anti-allergic, anti-inflammatory and cytoprotecyive agents | MERCK FROSST CANADA, INC. (CA) | 1995-06-27 | — | — | US | disclosed |
| EP-0480716-A1 | Saturated hydroxyalkylquinoline acids as leukotriene antagonists | MERCK FROSST CANADA INC. (CA) | 1992-04-15 | — | — | EP | disclosed |