Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 2/20 | 0.31 |
| ▸ | NOS3 | P29474 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 1/20 | 0.31 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL18930685 | 0.75 | CYP1A2 (0.36) | CYP1A2CYP3A4CYP2C9HIF1A | |
| Acetic Acid SCHEMBL8631637 | 0.73 | FDPS (0.40) | CYP1A2CYP3A4CYP2C9HIF1ASLC7A5 | |
| SCHEMBL14900921 | 0.72 | — | — | |
| SCHEMBL8313066 | 0.72 | — | — | |
| SCHEMBL14821640 | 0.72 | — | — | |
| SCHEMBL24162988 | 0.72 | — | — | |
| SCHEMBL8346871 | 0.72 | — | — | |
| SCHEMBL20629534 | 0.72 | — | — | |
| SCHEMBL21345145 | 0.72 | — | — | |
| SCHEMBL12681459 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017158093-A1 | NANOPARTICLE COMPOSITIONS COMPRISING PLGA DERIVATIVES AND A LIPID | Københavns Universitet (DK) | 2017-09-21 | — | — | WO | disclosed |