Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 4/20 | 0.50 |
| ▸ | DRD2 | P14416 | 4/20 | 0.50 |
| ▸ | DRD4 | P21917 | 4/20 | 0.50 |
| ▸ | CNR2 | P34972 | 3/20 | 0.40 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | TEC | P42680 | 1/20 | 0.37 |
| ▸ | BTK | Q06187 | 1/20 | 0.37 |
| ▸ | KDM5A | P29375 | 1/20 | 0.37 |
| ▸ | TRPC6 | Q9Y210 | 2/20 | 0.36 |
| ▸ | UBE2M | P61081 | 2/20 | 0.36 |
| ▸ | DCUN1D1 | Q96GG9 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | GFER | P55789 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 2/20 | 0.36 |
| ▸ | MAP3K12 | Q12852 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | NOS3 | P29474 | 1/20 | 0.36 |
| ▸ | NOS1 | P29475 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL17844419 | 0.84 | CNR2 (0.48) | CNR2EGFRTECBTKKDM5A | |
| SCHEMBL15140526 | 0.83 | CNR2 (0.41) | HTR1ADRD2DRD4CNR2KDM5A | |
| SCHEMBL29556164 | 0.83 | CNR2 (0.41) | HTR1ADRD2DRD4CNR2KDM5A | |
| SCHEMBL29924785 | 0.82 | UBE2M (0.41) | HTR1ADRD2DRD4CNR2KDM5A | |
| SCHEMBL9943901 | 0.82 | CNR2 (0.49) | HTR1ADRD2DRD4CNR2EGFR | |
| SCHEMBL20139993 | 0.82 | DRD2 (0.54) | HTR1ADRD2DRD4CNR2KDM5A | |
| SCHEMBL20266326 | 0.82 | UBE2M (0.41) | HTR1ADRD2DRD4CNR2KDM5A | |
| SCHEMBL5352510 | 0.80 | TRPV3 (0.51) | HTR1ADRD2DRD4 | |
| SCHEMBL1557142 | 0.79 | HTR1A (0.39) | HTR1ADRD2DRD4CNR2KDM5A | |
| SCHEMBL901682 | 0.79 | ASIC3 (0.44) | NOS3NOS1 |
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-2022111624-A1 | BENZIMIDAZOLE DERIVATIVE AND PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF | 深圳信立泰药业股份有限公司 | 2022-06-02 | — | — | WO | disclosed |