Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXA2R | P21731 | 13/20 | 0.45 |
| ▸ | PTGDR2 | Q9Y5Y4 | 4/20 | 0.40 |
| ▸ | PTGDR | Q13258 | 5/20 | 0.39 |
| ▸ | PDE2A | O00408 | 3/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5835832 | 0.77 | TBXA2R (0.56) | TBXA2RPTGDRPDE2A | |
| SCHEMBL5777736 | 0.69 | TBXA2R (0.41) | TBXA2RPTGDR2CYP2C9AKR1B1 | |
| SCHEMBL5773541 | 0.69 | TBXA2R (0.55) | TBXA2RPTGDR2PTGDRPDE2AAKR1B1 | |
| SCHEMBL5835524 | 0.67 | TBXA2R (0.57) | TBXA2RPTGDRPDE2A | |
| SCHEMBL5776492 | 0.66 | TBXA2R (0.79) | TBXA2RPTGDRPDE2A | |
| SCHEMBL5835854 | 0.66 | TBXA2R (0.56) | TBXA2RPTGDRPDE2A | |
| SCHEMBL5778917 | 0.65 | TBXA2R (0.74) | TBXA2RPTGDR2PTGDRPDE2A | |
| SCHEMBL5776530 | 0.64 | TBXA2R (0.73) | TBXA2RPTGDRPDE2A | |
| SCHEMBL5777307 | 0.62 | TBXA2R (0.32) | TBXA2RPTGDR2CYP2C9AKR1B1 | |
| Diphenylsulfane SCHEMBL672237 | 0.62 | TDP1 (0.51) | CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1395590-B1 | DIHYDROPYRROLO¬1,2-A|INDOLE AND TETRAHYDROPYRIDO¬1,2-A|INDOLE DERIVATIVES AS PROSTAGLANDIN D2 RECEPTOR ANTAGONISTS | MERCK FROSST CANADA INC (CA) | 2006-09-27 | — | — | EP | disclosed |