Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYSLTR1 | Q9Y271 | 5/20 | 0.51 |
| ▸ | CYSLTR2 | Q9NS75 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.50 |
| ▸ | CYP2C8 | P10632 | 2/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.50 |
| ▸ | BLM | P54132 | 1/20 | 0.50 |
| ▸ | EGFR | P00533 | 1/20 | 0.50 |
| ▸ | ESR1 | P03372 | 1/20 | 0.50 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.50 |
| ▸ | FYN | P06241 | 1/20 | 0.50 |
| ▸ | PGR | P06401 | 1/20 | 0.50 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.50 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.50 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.50 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.50 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.50 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.50 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL3979199 | 0.84 | CYSLTR1 (0.61) | CYSLTR1CYSLTR2MEN1KMT2AABCB11 | |
| SCHEMBL5274558 | 0.84 | CYSLTR1 (0.61) | CYSLTR1CYSLTR2MEN1KMT2AABCB11 | |
| SCHEMBL625607 | 0.83 | CYSLTR1 (0.52) | CYSLTR1CYSLTR2MEN1KMT2AABCB11 | |
| SCHEMBL15921355 | 0.81 | CYSLTR1 (0.54) | CYSLTR1CYSLTR2MEN1KMT2AABCB11 | |
| SCHEMBL5275768 | 0.79 | CYSLTR1 (0.48) | CYSLTR1CYSLTR2MEN1KMT2AABCB11 | |
| SCHEMBL5271947 | 0.79 | CYSLTR1 (0.48) | CYSLTR1CYSLTR2MEN1KMT2AABCB11 | |
| SCHEMBL3041868 | 0.77 | CYSLTR1 (0.79) | CYSLTR1CYSLTR2MEN1KMT2AABCB11 | |
| SCHEMBL4742853 | 0.77 | CYSLTR1 (0.79) | CYSLTR1CYSLTR2MEN1KMT2AABCB11 | |
| SCHEMBL4248355 | 0.75 | CYSLTR1 (0.57) | CYSLTR1CYSLTR2MEN1KMT2AABCB11 | |
| SCHEMBL16332941 | 0.75 | CYSLTR1 (0.62) | CYSLTR1CYSLTR2MEN1KMT2AABCB11 |
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-1853563-A1 | SALT OF MONTELUKAST WITH TERT.-BUTYLAMINE | INSTYTUT FARMACEUTYCZNY (PL) | 2007-11-14 | — | — | EP | disclosed |
| WO-2006043846-A1 | SALT OF MONTELUKAST WITH TERT.-BUTYLAMINE | INSTYTUT FARMACEUTYCZNY (PL) | 2006-04-27 | — | — | WO | disclosed |