Use the buttons at the bottom of Jsmol viewer to see different representations, ON/OFF Hydrogens, and ON/OFF rotation.
3D model is for representation purpose only.
.
.
Schematic representation of peptide, linker and drug in the peptide-drug conjugates
 |
 |
 |
|
 |
|---|---|---|---|---|
| AKCRKRA | succinic acid | Anthraquinone derivative |
| Identification | |
|---|---|
| ConjuPepDB ID | cpd01528 |
| Smiles | |
| Molecular weight | 1179.6 |
| Molecular formula | C53H81N17O12S |
| Chemical name | Peptide information |
| Sequence (one letter) | AKCRKRA |
| Length | 7 |
| Peptide name | partially truncated AP-1-like peptide |
| External ID | |
|---|---|
| CAS number | 332180-32-2 |
| Other information | |
|---|---|
| Application | Anticancer therapy, cell proliferation and malignant transformation inhibition |
| Additional function | AP-1 transcription factor inhibition |
| Pharmacological class | anticancer |
| Conjugate type | amide |
| Linker | N/A |
| Linker Type | succinic acid |
| Small molecule | Anthraquinone derivative |
| Small molecule CAS | 69940-76-7 |
| Structure method | EMSA |
| Calculated properties | |
|---|---|
| LogP | -7.18696 |
| Rotatable bonds | 38 |
| H bond donor | 19 |
| H bond acceptor | 21 |
| Polar surface area (PSA) | 492.11000 |
| Citations | |||||
|---|---|---|---|---|---|
| ID | Title | Year | Authors | Journal | DOI |
Anthraquinone-peptides as inhibitors of AP-1 transcription factor | 2001 | Ijaz, T.; Tran, P.; Ruparelia, K. C.; Teesdale-Spittle, P. H.; Orr, S.; Patterson, L. H. | Bioorganic & Medicinal Chemistry Letters | ||
