Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Bendazac. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 6/20 | 0.70 |
| ▸ | CNR1 | P21554 | 4/20 | 0.70 |
| ▸ | ACHE | P22303 | 4/20 | 0.70 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.60 |
| ▸ | GUCY1B2 | O75343 | 1/20 | 0.60 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.60 |
| ▸ | HTR1A | P08908 | 1/20 | 0.60 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.60 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.60 |
| ▸ | DRD1 | P21728 | 1/20 | 0.60 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.60 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.60 |
| ▸ | GUCY1A2 | P33402 | 1/20 | 0.60 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.60 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.60 |
| ▸ | DRD3 | P35462 | 1/20 | 0.60 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.60 |
| ▸ | GUCY1A1 | Q02108 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| Bendazac SCHEMBL25979 | 1.00 | CNR2 (0.70) | CNR2CNR1ACHEKDM4ECYP1A2 | |
| Bendazac SCHEMBL11689792 | 0.99 | CNR2 (0.68) | CNR2CNR1ACHEKDM4ECYP1A2 | |
| SCHEMBL8415791 | 0.91 | CNR1 (0.59) | CNR2CNR1ACHEKDM4ECYP1A2 | |
| SCHEMBL9186085 | 0.91 | CNR1 (0.58) | CNR2CNR1ACHEKDM4ECYP1A2 | |
| SCHEMBL11691268 | 0.90 | CNR2 (0.68) | CNR2CNR1ACHEKDM4ECYP1A2 | |
| SCHEMBL6966754 | 0.89 | CNR2 (0.67) | CNR2CNR1ACHEKDM4ECYP1A2 | |
| SCHEMBL12608904 | 0.89 | CNR2 (0.67) | CNR2CNR1ACHEKDM4ECYP1A2 | |
| Bendazac SCHEMBL1649722 | 0.88 | CNR2 (0.65) | CNR2CNR1ACHEKDM4ECYP1A2 | |
| SCHEMBL28910049 | 0.87 | CNR1 (0.64) | CNR2CNR1ACHEKDM4ECYP1A2 | |
| SCHEMBL8673918 | 0.86 | CNR2 (0.58) | CNR2CNR1ACHEKDM4ECYP1A2 |
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-117098517-A | Drug eluting stent | 赛诺医疗科学技术股份有限公司 | 2023-11-21 | — | — | CN | disclosed |
| WO-2023038093-A1 | DEUTERIUM-ENRICHED COMPOSITION, DEUTERIUM-SUBSTITUTED CARBOXYLIC ACID PRODUCTION METHOD, REACTION ACCELERATOR, AND USE OF COMPOUND FOR CONVERTING CARBOXYLIC ACID TO ACID ANHYDRIDE | 国立大学法人九州大学 | 2023-03-16 | — | — | WO | disclosed |