Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTNNB1 | P35222 | 13/20 | 0.46 |
| ▸ | TCF7L2 | Q9NQB0 | 13/20 | 0.46 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.43 |
| ▸ | GRK6 | P43250 | 2/20 | 0.42 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.41 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.38 |
| ▸ | PDE5A | O76074 | 1/20 | 0.38 |
| ▸ | AURKA | O14965 | 1/20 | 0.38 |
| ▸ | IGF1R | P08069 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8889431 | 0.72 | EGFR (0.43) | CTNNB1TCF7L2P2RX3 | |
| SCHEMBL8891133 | 0.72 | NPY5R (0.46) | CTNNB1TCF7L2PDE5A | |
| SCHEMBL4170114 | 0.63 | CTNNB1 (1.00) | CTNNB1TCF7L2 | |
| SCHEMBL4174294 | 0.61 | CTNNB1 (0.78) | CTNNB1TCF7L2 | |
| SCHEMBL30380040 | 0.60 | CYP1A2 (0.56) | — | |
| SCHEMBL20682390 | 0.60 | L3MBTL1 (0.46) | — | |
| SCHEMBL4160385 | 0.59 | CTNNB1 (1.00) | CTNNB1TCF7L2 | |
| SCHEMBL6039137 | 0.59 | NPY5R (0.57) | SLC2A1 | |
| SCHEMBL5569927 | 0.59 | KDM4E (0.74) | — | |
| SCHEMBL7254867 | 0.59 | PIN1 (0.57) | PDE5A |
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-1997020822-A1 | QUINAZOLIN-2,4-DIAZIRINES AS NPY RECEPTOR ANTAGONIST | NOVARTIS AG (CH) | 1997-06-12 | — | — | WO | disclosed |