Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB4 | P30926 | 1/20 | 0.49 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 8/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.36 |
| ▸ | SLC18A3 | Q16572 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CASP3 | P42574 | 1/20 | 0.35 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.35 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.34 |
| ▸ | CCR5 | P51681 | 2/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2210855 | 0.92 | CHRNB4 (0.49) | CHRNB4CHRNA3SLC18A3POLB | |
| SCHEMBL4639958 | 0.92 | CHRNB4 (0.45) | CHRNB4CHRNA3CYP2C9KCNH2TRPM8 | |
| SCHEMBL4640229 | 0.89 | CHRNB4 (0.42) | CHRNB4CHRNA3CYP2C9KCNH2TRPM8 | |
| SCHEMBL4639854 | 0.89 | CYP2C9 (0.41) | CHRNB4CHRNA3CYP2C9KCNH2TRPM8 | |
| SCHEMBL4640438 | 0.84 | NPC1 (0.39) | CHRNB4CHRNA3CYP2C9KCNH2TRPM8 | |
| SCHEMBL4620189 | 0.83 | NLRP3 (0.47) | CHRNB4CHRNA3POLB | |
| SCHEMBL2208302 | 0.80 | CHRNB4 (0.42) | CHRNB4CHRNA3CYP2C9 | |
| SCHEMBL4621179 | 0.75 | SCD5 (0.39) | CHRNB4CHRNA3CYP2C9SLC18A3POLB | |
| SCHEMBL5011255 | 0.75 | KMT2A (0.43) | CHRNB4CHRNA3POLB | |
| SCHEMBL2207499 | 0.75 | CHRNB4 (0.49) | CHRNB4CHRNA3POLB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1888542-A1 | SUBSTITUTED SPIRO-COMPOUNDS AND THE USE THEREOF FOR PRODUCING MEDICAMENTS | Grünenthal GmbH (DE) | 2008-02-20 | — | — | EP | claimed |
| WO-2006136245-A1 | SUBSTITUTED SPIRO-COMPOUNDS AND THE USE THEREOF FOR PRODUCING MEDICAMENTS | Grünenthal GmbH (DE) | 2006-12-28 | — | — | WO | claimed |