Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 7/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.40 |
| ▸ | PLAU | P00749 | 2/20 | 0.40 |
| ▸ | NOS3 | P29474 | 1/20 | 0.39 |
| ▸ | NOS1 | P29475 | 1/20 | 0.39 |
| ▸ | NOS2 | P35228 | 1/20 | 0.39 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.38 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.38 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.38 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.38 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.38 |
| ▸ | HTR3B | O95264 | 1/20 | 0.38 |
| ▸ | HTR3A | P46098 | 1/20 | 0.38 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.38 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.38 |
| ▸ | F2 | P00734 | 2/20 | 0.36 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.36 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5594310 | 0.80 | PLAU (0.41) | PTGS2PLAUNOS3NOS1NOS2 | |
| SCHEMBL5594064 | 0.79 | KDM4E (0.50) | PTGS2NOS3NOS1NOS2PTGS1 | |
| SCHEMBL4854998 | 0.78 | CYP2D6 (0.60) | PTGS2PLAUNOS3NOS1NOS2 | |
| SCHEMBL5595201 | 0.78 | CYP2D6 (0.60) | PTGS2PLAUNOS3NOS1NOS2 | |
| SCHEMBL5594294 | 0.78 | P2RX7 (0.41) | PTGS2NOS3NOS1NOS2PTGS1 | |
| SCHEMBL5594531 | 0.77 | NOS3 (0.51) | ADRA2AADRA2BADRA2CPLAUNOS3 | |
| SCHEMBL5594283 | 0.75 | ADRA2A (0.46) | PTGS2ADRA2AADRA2BADRA2CNOS3 | |
| SCHEMBL7451804 | 0.74 | PTGS2 (0.45) | PTGS2GPR119 | |
| SCHEMBL5594753 | 0.72 | P2RX7 (0.43) | PTGS2PLAUNOS3NOS1NOS2 | |
| SCHEMBL11879362 | 0.71 | POLB (0.58) | ADRA2AADRA2BADRA2CPLAUNOS3 |
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 |
|---|---|---|---|---|---|---|---|
| US-5616601-A | 1,2-aryl and heteroaryl substituted imidazolyl compounds for the treatment of inflammation | GD SEARLE & CO (US) | 1997-04-01 | — | — | US | disclosed |