Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.53 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.52 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.52 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.52 |
| ▸ | PDE10A | Q9Y233 | 3/20 | 0.51 |
| ▸ | CYSLTR1 | Q9Y271 | 10/20 | 0.49 |
| ▸ | CYSLTR2 | Q9NS75 | 7/20 | 0.49 |
| ▸ | PPARG | P37231 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL9757036 | 0.90 | CYSLTR1 (0.53) | GPBAR1ALOX5PDE10ACYSLTR1CYSLTR2 | |
| SCHEMBL9757054 | 0.85 | PDE10A (0.58) | GPBAR1FFAR1AKR1B1ALOX5PDE10A | |
| SCHEMBL9757076 | 0.78 | ALOX5 (0.59) | GPBAR1ALOX5PDE10ACYSLTR1CYSLTR2 | |
| SCHEMBL9757119 | 0.77 | PDE10A (0.54) | GPBAR1FFAR1AKR1B1ALOX5PDE10A | |
| SCHEMBL9757233 | 0.76 | CYSLTR1 (0.55) | GPBAR1FFAR1AKR1B1ALOX5PDE10A | |
| SCHEMBL9022146 | 0.76 | GPBAR1 (0.66) | GPBAR1FFAR1AKR1B1ALOX5CYSLTR1 | |
| SCHEMBL7457682 | 0.76 | GPBAR1 (0.90) | GPBAR1FFAR1AKR1B1ALOX5PDE10A | |
| SCHEMBL7718896 | 0.76 | GPBAR1 (0.90) | GPBAR1FFAR1AKR1B1ALOX5PDE10A | |
| SCHEMBL6088569 | 0.76 | FFAR1 (0.73) | GPBAR1FFAR1AKR1B1ALOX5CYSLTR1 | |
| SCHEMBL9756934 | 0.75 | CYSLTR1 (0.60) | GPBAR1FFAR1AKR1B1ALOX5PDE10A |
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 |
|---|---|---|---|---|---|---|---|
| WO-1991019475-A2 | QUINOLINYL-BENZOHETEROBICYCLIC DERIVATIVES AS ANTAGONISTS OF LEUKOTRIENE D¿4? | RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) | 1991-12-26 | — | — | WO | disclosed |
| US-5041453-A | Quinolinyl-benzoheterobicyclic derivatives as antagonists of leukotriene D4 | RHONE-POULENC RORER PHARMACEUTICALS INC. (US) | 1991-08-20 | — | — | US | disclosed |