Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.33 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.31 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.31 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4755585 | 1.00 | TSHR (0.41) | TSHRSMN1; SMN2CHRNB2CHRNA7CHRNA4 | |
| SCHEMBL4755724 | 0.81 | SMN1; SMN2 (0.39) | TSHRSMN1; SMN2 | |
| SCHEMBL4753663 | 0.81 | SMN1; SMN2 (0.39) | TSHRSMN1; SMN2 | |
| SCHEMBL4753664 | 0.81 | SMN1; SMN2 (0.39) | TSHRSMN1; SMN2 | |
| SCHEMBL4755728 | 0.81 | SMN1; SMN2 (0.39) | TSHRSMN1; SMN2 | |
| SCHEMBL4753774 | 0.73 | SMN1; SMN2 (0.38) | TSHRSMN1; SMN2 | |
| SCHEMBL4753772 | 0.73 | SMN1; SMN2 (0.38) | TSHRSMN1; SMN2 | |
| SCHEMBL4756550 | 0.72 | SMN1; SMN2 (0.35) | TSHRSMN1; SMN2 | |
| SCHEMBL4756545 | 0.72 | SMN1; SMN2 (0.35) | TSHRSMN1; SMN2 | |
| SCHEMBL2326348 | 0.71 | SMN1; SMN2 (0.50) | TSHRSMN1; SMN2KEAP1NFE2L2HCAR2 |
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-2008156607-A1 | SUBSTITUTED PYRIMIDINONES | NEUROGEN CORPORATION (US) | 2008-12-24 | — | — | WO | disclosed |