Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXAS1 | P24557 | 4/20 | 0.58 |
| ▸ | GPR35 | Q9HC97 | 4/20 | 0.54 |
| ▸ | RXFP1 | Q9HBX9 | 3/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | PRNP | P04156 | 1/20 | 0.41 |
| ▸ | MCL1 | Q07820 | 4/20 | 0.40 |
| ▸ | BCL2L1 | Q07817 | 2/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.38 |
| ▸ | EDNRA | P25101 | 1/20 | 0.38 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.37 |
| ▸ | BCKDK | O14874 | 1/20 | 0.36 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.35 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.35 |
| ▸ | BCL2 | P10415 | 1/20 | 0.35 |
| ▸ | BAD | Q92934 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL31207832 | 0.88 | TBXAS1 (0.58) | TBXAS1GPR35RXFP1PKMNPSR1 | |
| SCHEMBL10948748 | 0.86 | TBXAS1 (0.60) | TBXAS1GPR35RXFP1PKMNPSR1 | |
| SCHEMBL9613211 | 0.86 | TBXAS1 (0.60) | TBXAS1GPR35RXFP1PKMNPSR1 | |
| SCHEMBL2896475 | 0.80 | GPR35 (0.58) | TBXAS1GPR35RXFP1PKMNPSR1 | |
| SCHEMBL2895952 | 0.79 | GPR35 (0.62) | TBXAS1GPR35RXFP1PKMNPSR1 | |
| SCHEMBL9757077 | 0.78 | GPR35 (0.65) | TBXAS1GPR35RXFP1PKMNPSR1 | |
| SCHEMBL1066852 | 0.76 | GPR35 (0.58) | TBXAS1GPR35RXFP1PKMNPSR1 | |
| SCHEMBL122587 | 0.76 | GPR35 (0.58) | TBXAS1GPR35RXFP1PKMNPSR1 | |
| SCHEMBL2893771 | 0.76 | GPR35 (0.58) | TBXAS1GPR35RXFP1PKMNPSR1 | |
| SCHEMBL11287291 | 0.75 | TBXAS1 (0.55) | TBXAS1GPR35RXFP1PKMNPSR1 |
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 |