Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9757019 | 0.91 | PTPN1 (0.38) | ALDH1A1HPGDHSD17B10HCAR2GAA | |
| SCHEMBL9757055 | 0.71 | DPP4 (0.43) | ALDH1A1HSD17B10GAAL3MBTL1 | |
| SCHEMBL9757423 | 0.64 | DAGLA (0.41) | — | |
| SCHEMBL9757021 | 0.63 | MCL1 (0.35) | ALDH1A1HPGDHSD17B10GAA | |
| SCHEMBL13426929 | 0.63 | TSHR (0.38) | ALDH1A1HPGDHSD17B10TDP1L3MBTL1 | |
| SCHEMBL27691281 | 0.62 | TDP1 (0.41) | ALDH1A1HSD17B10HCAR2CYP2C19TDP1 | |
| SCHEMBL9757047 | 0.61 | ALOX5 (0.42) | ALDH1A1HSD17B10 | |
| SCHEMBL17035398 | 0.61 | GAA (0.42) | ALDH1A1HPGDHSD17B10GAAPOLB | |
| SCHEMBL28750906 | 0.60 | CLCN2 (0.48) | ALDH1A1HPGDHSD17B10TDP1 | |
| SCHEMBL3641151 | 0.60 | XDH (0.55) | ALDH1A1HPGDHSD17B10GAAPOLB |
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 |