Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 5/20 | 0.49 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | OGA | O60502 | 1/20 | 0.46 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | HTR2C | P28335 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | HTR2B | P41595 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | JAK2 | O60674 | 1/20 | 0.42 |
| ▸ | TYK2 | P29597 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5048965 | 0.85 | CYP1A2 (0.50) | CYP1A2CYP2C19NPSR1MAPTPOLB | |
| SCHEMBL1093009 | 0.80 | MAPT (0.47) | MAPTPOLBOGANPC1RAB9A | |
| SCHEMBL11903830 | 0.78 | MAPT (0.61) | CYP1A2CYP2C19NPSR1MAPTMAOA | |
| SCHEMBL10845230 | 0.74 | NPC1 (0.61) | CYP1A2CYP2C19NPSR1MAPTMAOA | |
| SCHEMBL8940100 | 0.73 | RXRA (0.49) | MAPTKDM4EALDH1A1GLA | |
| SCHEMBL2249683 | 0.72 | CYP1A2 (0.69) | CYP1A2CYP2C19NPSR1MAPTPOLB | |
| SCHEMBL17417902 | 0.72 | CYP1A2 (0.55) | CYP1A2CYP2C19NPSR1MAPTPOLB | |
| SCHEMBL282032 | 0.72 | ALDH1A1 (0.60) | MAPTOGAHTR2BMEN1KMT2A | |
| SCHEMBL394762 | 0.71 | CYP1A2 (0.61) | CYP1A2CYP2C19NPSR1MAPTPOLB | |
| SCHEMBL15553344 | 0.70 | BRAF (0.58) | CYP1A2CYP2C19NPSR1MAPTOGA |
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-2024030651-A1 | GPX4 INHIBITORS AND USE THEREOF | SONATA THERAPEUTICS, INC. (US) | 2024-02-08 | — | — | WO | disclosed |