Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES | O14684 | 3/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.35 |
| ▸ | WDR5 | P61964 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.34 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CASR | P41180 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL11467215 | 0.77 | SCN9A (0.40) | PTGESMCL1MAPTNOTUMWDR5 | |
| SCHEMBL11470501 | 0.76 | MAPT (0.40) | MCL1MAPTNOTUMWDR5ADORA2A | |
| SCHEMBL11873100 | 0.75 | MAP4K4 (0.40) | MCL1MAPTNOTUMWDR5ADORA2A | |
| SCHEMBL11478497 | 0.74 | CASR (0.38) | PTGESHTR2AHTR2CHTR2BMAPT | |
| SCHEMBL11485099 | 0.74 | PTGES (0.35) | PTGESMCL1MAPTNOTUMWDR5 | |
| SCHEMBL11231697 | 0.74 | KDM4E (0.39) | PTGESMCL1MAPTNOTUMWDR5 | |
| SCHEMBL11468034 | 0.73 | RAB9A (0.41) | MAPTTP53ALDH1A1GAARAB9A | |
| SCHEMBL11477369 | 0.73 | CACNA2D1 (0.45) | MAPTTP53ALDH1A1GAARAB9A | |
| SCHEMBL11243005 | 0.73 | NPSR1 (0.58) | PTGESMCL1MAPTNOTUMWDR5 | |
| SCHEMBL11482987 | 0.72 | GPR84 (0.62) | PTGESMAPTWDR5TP53RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-4190725-A | ANTIINFLAMMATORY | ELI LILLY AND COMPANY (US) | 1980-02-26 | — | — | US | disclosed |
| US-4021553-A | 5,6-Diaryl-1,2,4-triazines as topically-active anti-inflammatory agents | ELI LILLY AND COMPANY (US) | 1977-05-03 | — | — | US | disclosed |