Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 2/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2944609 | 0.76 | ROCK1 (0.49) | ROCK1 | |
| SCHEMBL2431671 | 0.73 | — | — | |
| SCHEMBL9757026 | 0.71 | TBXAS1 (0.58) | ROCK1TBXAS1 | |
| SCHEMBL23261474 | 0.71 | GPR3 (0.44) | ROCK1 | |
| SCHEMBL10018350 | 0.70 | PIM1 (0.35) | — | |
| SCHEMBL19436248 | 0.68 | FFAR1 (0.47) | FFAR1 | |
| SCHEMBL8077973 | 0.67 | AKR1C3 (0.39) | — | |
| SCHEMBL2950164 | 0.67 | RXRA (0.43) | NPC1TBXAS1 | |
| SCHEMBL9173922 | 0.67 | PTPN1 (0.43) | — | |
| SCHEMBL9757116 | 0.66 | PTPN2 (0.37) | — |
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 |