Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB4 | P30926 | 1/20 | 0.55 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.55 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | SSTR5 | P35346 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL2205534 | 0.88 | CHRNB4 (0.52) | CHRNB4CHRNA3NLRP3RECQLSSTR5 | |
| SCHEMBL4643127 | 0.84 | CHRNB4 (0.40) | CHRNB4CHRNA3CYP2C9KCNH2 | |
| SCHEMBL10210780 | 0.72 | CHRNB4 (0.55) | CHRNB4CHRNA3NLRP3RECQLSSTR5 | |
| SCHEMBL2210658 | 0.71 | CHRNB4 (0.36) | CHRNB4CHRNA3NLRP3RECQLTDP1 | |
| SCHEMBL5015649 | 0.71 | CHRNB4 (0.54) | CHRNB4CHRNA3NLRP3RECQLCYP2C9 | |
| SCHEMBL895210 | 0.71 | CHRNB4 (0.54) | CHRNB4CHRNA3NLRP3RECQLSSTR5 | |
| SCHEMBL14534188 | 0.71 | CHRNB4 (0.53) | CHRNB4CHRNA3NLRP3RECQLSSTR5 | |
| Ammonia Solution, Strong SCHEMBL5126795 | 0.70 | CHRNB4 (0.53) | CHRNB4CHRNA3NLRP3RECQLCYP2C9 | |
| SCHEMBL5015653 | 0.70 | CHRNB4 (0.52) | CHRNB4CHRNA3NLRP3RECQLSSTR5 | |
| SCHEMBL10168605 | 0.69 | CHRNB4 (0.52) | CHRNB4CHRNA3NLRP3RECQLSSTR5 |
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 4 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 |
| EP-1888542-A1 | SUBSTITUTED SPIRO-COMPOUNDS AND THE USE THEREOF FOR PRODUCING MEDICAMENTS | Grünenthal GmbH (DE) | 2008-02-20 | — | — | EP | disclosed |
| WO-2006136245-A1 | SUBSTITUTED SPIRO-COMPOUNDS AND THE USE THEREOF FOR PRODUCING MEDICAMENTS | Grünenthal GmbH (DE) | 2006-12-28 | — | — | WO | disclosed |