Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYSLTR1 | Q9Y271 | 8/20 | 0.67 |
| ▸ | CYSLTR2 | Q9NS75 | 2/20 | 0.67 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.43 |
| ▸ | GPBAR1 | Q8TDU6 | 5/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | THPO | P40225 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Ritolukast SCHEMBL38043 | 0.81 | CYSLTR1 (1.00) | CYSLTR1CYSLTR2PDE10AGPBAR1KDM4E | |
| SCHEMBL10685299 | 0.79 | CYSLTR1 (0.80) | CYSLTR1CYSLTR2PDE10A | |
| SCHEMBL14021761 | 0.71 | CYSLTR1 (0.68) | CYSLTR1CYSLTR2PDE10AGPBAR1 | |
| SCHEMBL10375899 | 0.69 | CYSLTR1 (0.68) | CYSLTR1CYSLTR2GPBAR1 | |
| SCHEMBL10375898 | 0.68 | CYSLTR1 (0.67) | CYSLTR1CYSLTR2GPBAR1MEN1ALDH1A1 | |
| SCHEMBL10547192 | 0.67 | CYSLTR1 (0.59) | CYSLTR1CYSLTR2PDE10AGPBAR1KDM4E | |
| SCHEMBL9715793 | 0.67 | GPBAR1 (0.47) | CYSLTR1CYSLTR2GPBAR1KDM4EMEN1 | |
| SCHEMBL7710816 | 0.67 | CYSLTR1 (0.64) | CYSLTR1CYSLTR2PDE10AGPBAR1MEN1 | |
| SCHEMBL13114986 | 0.66 | CYSLTR1 (0.48) | CYSLTR1CYSLTR2PDE10AGPBAR1 | |
| SCHEMBL6427215 | 0.65 | CYSLTR2 (0.52) | CYSLTR1CYSLTR2ALDH1A1MAPT |
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-5086180-A | Hydrolysis of ester an ddecarboxylation leukotriene antagonists | CHEMISCH PHARMAZEUTISCHE FORSCHUNGSGESELLSCHAFT M.B.H. (AT) | 1992-02-04 | — | — | US | disclosed |