Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5AP | P20292 | 3/20 | 0.48 |
| ▸ | FEN1 | P39748 | 3/20 | 0.48 |
| ▸ | NOS3 | P29474 | 2/20 | 0.43 |
| ▸ | NOS1 | P29475 | 2/20 | 0.43 |
| ▸ | NOS2 | P35228 | 2/20 | 0.43 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.40 |
| ▸ | IKBKB | O14920 | 1/20 | 0.39 |
| ▸ | CHUK | O15111 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | MCHR1 | Q99705 | 3/20 | 0.38 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.38 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.38 |
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.38 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | PIM1 | P11309 | 2/20 | 0.36 |
| ▸ | PIM2 | Q9P1W9 | 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 | |
|---|---|---|---|---|
| SCHEMBL221925 | 0.79 | ROCK1 (0.47) | ALOX5APFEN1NOS3NOS1NOS2 | |
| SCHEMBL5833938 | 0.74 | NOS3 (0.64) | ALOX5APFEN1NOS3NOS1NOS2 | |
| SCHEMBL221743 | 0.72 | PRKCZ (0.45) | NOS3NOS1NOS2CHRNB2CHRNA4 | |
| SCHEMBL221461 | 0.71 | PRKCZ (0.43) | NOS3NOS1NOS2CHRNB2CHRNA4 | |
| SCHEMBL5833614 | 0.71 | NOS3 (0.49) | ALOX5APFEN1NOS3NOS1NOS2 | |
| SCHEMBL7888500 | 0.70 | SLC6A2 (0.50) | ALOX5APFEN1IKBKBCHUKHTR1A | |
| SCHEMBL7447984 | 0.69 | NOS3 (0.53) | NOS3NOS1NOS2MCHR1 | |
| SCHEMBL218696 | 0.69 | PDE7A (0.46) | NOS3NOS1NOS2ROCK1CHEK1 | |
| SCHEMBL5833226 | 0.69 | NOS3 (0.65) | NOS3NOS1NOS2HTR1ASLC6A2 | |
| SCHEMBL23582852 | 0.68 | IRAK4 (0.51) | ALOX5APFEN1IKBKBCHUKHTR1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1178784-A1 | NEW PHARMACEUTICAL COMBINATIONS FOR NOS INHIBITORS | Pfizer Products Inc. (US) | 2002-02-13 | — | — | EP | disclosed |
| WO-2000071107-A2 | NEW PHARMACEUTICAL COMBINATIONS FOR NOS INHIBITORS | PFIZER PRODUCTS INC. (US) | 2000-11-30 | — | — | WO | disclosed |