Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.38 |
| ▸ | TSPO | P30536 | 3/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.35 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.35 |
| ▸ | CDK9 | P50750 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL25596778 | 0.84 | ALDH1A1 (0.39) | SIGMAR1CYP2D6USP2CHRNB4CHRNA3 | |
| SCHEMBL25269079 | 0.81 | CCNT1 (0.38) | CYP2D6CHRNB4CHRNA3TSPOOPRK1 | |
| SCHEMBL20070372 | 0.80 | SIGMAR1 (0.56) | SIGMAR1CYP2D6USP2CYP1A2CYP2C19 | |
| Hydrochloric Acid SCHEMBL20138396 | 0.78 | SIGMAR1 (0.55) | SIGMAR1CYP2D6USP2SLC6A2SLC6A4 | |
| SCHEMBL5498128 | 0.73 | SIGMAR1 (0.49) | SIGMAR1CYP2D6USP2OPRK1CYP1A2 | |
| SCHEMBL16657601 | 0.72 | FPR2 (0.53) | SIGMAR1CYP2D6USP2CA2SLC6A2 | |
| SCHEMBL27932886 | 0.72 | GAA (0.51) | SIGMAR1CYP2D6USP2OPRK1CYP1A2 | |
| SCHEMBL25597095 | 0.71 | SIGMAR1 (0.40) | SIGMAR1CHRNB4CHRNA3OPRK1CCNT1 | |
| Hydrochloric Acid SCHEMBL28086905 | 0.71 | FPR2 (0.52) | SIGMAR1CYP2D6USP2CA2SLC6A2 | |
| SCHEMBL25270370 | 0.71 | CCNT1 (0.34) | CYP2D6CHRNB4CHRNA3TSPOOPRK1 |
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-2023107547-A2 | AZETIDINE AND SPIROAZETIDINE COMPOUNDS AND USES THEREOF | Kineta, Inc. (US) | 2023-06-15 | — | — | WO | disclosed |