Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRL1 | P41146 | 2/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.33 |
| ▸ | F2 | P00734 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.31 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.31 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | MAP3K14 | Q99558 | 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 | |
|---|---|---|---|---|
| SCHEMBL28955569 | 0.91 | SIGMAR1 (0.35) | OPRL1SIGMAR1F2KCNH2 | |
| SCHEMBL23364949 | 0.82 | CYP1A2 (0.41) | OPRL1SIGMAR1F2ADRA2AADRA2B | |
| SCHEMBL15894659 | 0.82 | CYP1A2 (0.41) | OPRL1SIGMAR1F2ADRA2AADRA2B | |
| SCHEMBL23364950 | 0.82 | CYP1A2 (0.41) | OPRL1SIGMAR1F2ADRA2AADRA2B | |
| SCHEMBL25215626 | 0.78 | F2 (0.35) | OPRL1SIGMAR1F2KCNH2 | |
| SCHEMBL15891606 | 0.77 | OPRL1 (0.34) | OPRL1F2KCNH2MAP3K14 | |
| SCHEMBL23364947 | 0.73 | CYP1A2 (0.39) | OPRL1SIGMAR1F2ADRA2AADRA2B | |
| SCHEMBL15894663 | 0.73 | CYP1A2 (0.39) | OPRL1SIGMAR1F2ADRA2AADRA2B | |
| SCHEMBL22743930 | 0.71 | OPRL1 (0.46) | OPRL1KCNH2MAP3K14 | |
| SCHEMBL30656312 | 0.71 | OPRL1 (0.46) | OPRL1KCNH2MAP3K14 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115551841-A | Azetidin-3-ylcarbinol derivatives as modulators of the CCR6 receptor | 爱杜西亚药品有限公司 | 2022-12-30 | — | — | CN | claimed |
| CN-115551841-A | Azetidin-3-ylcarbinol derivatives as modulators of the CCR6 receptor | 爱杜西亚药品有限公司 | 2022-12-30 | — | — | CN | disclosed |