Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 5/20 | 0.43 |
| ▸ | CHRNA7 | P36544 | 4/20 | 0.43 |
| ▸ | CHRNA4 | P43681 | 4/20 | 0.43 |
| ▸ | CHRNB4 | P30926 | 4/20 | 0.43 |
| ▸ | CHRNA3 | P32297 | 4/20 | 0.43 |
| ▸ | CHRNB1 | P11230 | 3/20 | 0.43 |
| ▸ | CHRNB3 | Q05901 | 3/20 | 0.43 |
| ▸ | CHRNA1 | P02708 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | CHRNA2 | Q15822 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.39 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | HTR3B | O95264 | 1/20 | 0.39 |
| ▸ | CHRNG | P07510 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9490122 | 1.00 | CHRNB2 (0.43) | CHRNB2CHRNA7CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL9492862 | 1.00 | CHRNB2 (0.43) | CHRNB2CHRNA7CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL9491388 | 1.00 | CHRNB2 (0.43) | CHRNB2CHRNA7CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL9655993 | 1.00 | CHRNB2 (0.43) | CHRNB2CHRNA7CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL9656446 | 0.79 | CHRNB2 (0.41) | CHRNB2CHRNA7CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL9656460 | 0.79 | CHRNB2 (0.41) | CHRNB2CHRNA7CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL9328846 | 0.79 | CHRNB2 (0.41) | CHRNB2CHRNA7CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL9328852 | 0.79 | CHRNB2 (0.41) | CHRNB2CHRNA7CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL9656452 | 0.79 | CHRNB2 (0.41) | CHRNB2CHRNA7CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL31643342 | 0.71 | KCNH2 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5246950-A | Smooth muscle disorders | RHONE-POULENC SANTE (FR) | 1993-09-21 | — | — | US | disclosed |