Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 3/20 | 0.37 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | NISCH | Q9Y2I1 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1866073 | 0.91 | HTR2A (0.38) | CHRNB2CHRNA4HTR2ANISCHCYP3A4 | |
| SCHEMBL1860147 | 0.91 | HTR2A (0.38) | CHRNB2CHRNA4HTR2ANISCHCYP3A4 | |
| SCHEMBL1865938 | 0.91 | HTR2A (0.38) | CHRNB2CHRNA4HTR2ANISCHCYP3A4 | |
| SCHEMBL1866642 | 0.80 | ALDH1A1 (0.40) | CYP3A4MEN1KMT2AALDH1A1LMNA | |
| SCHEMBL1862411 | 0.80 | ALDH1A1 (0.40) | CYP3A4MEN1KMT2AALDH1A1LMNA | |
| SCHEMBL1862897 | 0.79 | LMNA (0.39) | CYP3A4MEN1KMT2AALDH1A1LMNA | |
| SCHEMBL1865507 | 0.78 | ALDH1A1 (0.42) | NISCHCYP3A4MEN1KMT2AALDH1A1 | |
| SCHEMBL654291 | 0.78 | HTR2A (0.47) | HTR2ANISCHGAATSHR | |
| SCHEMBL25225928 | 0.69 | MEN1 (0.44) | CHRNB2CHRNA4MEN1KMT2AALDH1A1 | |
| SCHEMBL29707062 | 0.69 | CHRNB2 (0.40) | CHRNB2CHRNA4 |
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-2011053705-A1 | PYRIMIDINE COMPOUNDS AS DELTA OPIOID RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2011-05-05 | — | — | WO | disclosed |