BIOPEP-UWM: Report
| ID | 10211 |
| Name | Acetylcholinesterase inhibitor |
| sequence |
| Function: | |||
| Inhibitor of Acetylcholinesterase (EC 3.1.1.7) | |||
| Number of residues | 8 |
Activity code | ache |
| Activity : | AChE inhibitor |
|||
| Chemical mass | 1096.3049 | Monoisotopic mass | 1095.5954 | |
| IC50 : | 102.20 µM |
|||
| Bibliographic data: | |
| Authors | |
| Dastan D., Zhiyani R., Fasihi K., Ebadi A. | |
| Title | |
| An arginine-rich peptide inhibits AChE: template-based design, molecular modeling, synthesis and biological evaluation. J. Mol. Model., 28, 86, 2022 | |
| Year | Source |
| 2022 | Journal |
| Additional information: |
| BIOPEP-UWM database of bioactive peptides SMILES: N[C@@]([H])(CCCNC(=N)N)C(=O)N[C@@]([H])(CCSC)C(=O)N[C@@]([H])(CC(C)C)C(=O)N[C@@]([H])(CCCNC(=N)N)C(=O)N[C@@]([H])([C@]([H])(O)C)C(=O)N[C@@]([H])([C@]([H])(O)C)C(=O)N[C@@]([H])(CCCNC(=N)N)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)O InChI=1S/C46H81N17O12S/c1-23(2)21-32(60-38(69)31(16-20-76-5)57-36(67)28(47)9-6-17-54-44(48)49)40(71)58-30(11-8-19-56-46(52)53)39(70)62-35(25(4)65)42(73)63-34(24(3)64)41(72)59-29(10-7-18-55-45(50)51)37(68)61-33(43(74)75)22-26-12-14-27(66)15-13-26/h12-15,23-25,28-35,64-66H,6-11,16-22,47H2,1-5H3,(H,57,67)(H,58,71)(H,59,72)(H,60,69)(H,61,68)(H,62,70)(H,63,73)(H,74,75)(H4,48,49,54)(H4,50,51,55)(H4,52,53,56)/t24-,25-,28+,29+,30+,31+,32+,33+,34+,35+/m1/s1 InChIKey=SGRJNCAHFCPLPL-QFTRKFIISA-N |
| Database reference: |