AK-1690 |
AK-1690 : Degrader (PROTAC) of STAT6
Probe Summary
Selectivity
Potency
In Vivo
Control Compounds
Chemical Information
References
Vendors
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Probe Summary
| Targets | Biochemical/Biophysical Potency | Cellular Potency |
|---|---|---|
| STAT6 |
|
Degrader (PROTAC)
up to 1 uM
Selectivity
In Cell Selectivity Assessment
Potency Assay Off-Target:
AK-1690 had no significant effect on STAT1, STAT3, STAT5, and pSTAT5Y694 up to 10 μM. AK-1690 had a ...
In Cell Selectivity Assessment
Potency Assay Off-Target:
Degradation selectivity of AK-1690 was evaluated on a global level by proteomics. Human PBMCs were t ...
Selectivity Assessment Description:
With 18 h treatment at 5 μM, AK-1690 reduced the levels of only four proteins by ≥50% out of >6,000 ...
In Cell Selectivity Assessment
Potency Assay Off-Target:
Western blot analysis of Jurkat cells treated with 10 uM AK-1690 has no effect on cereblon neo-subst ...
Potency Cellular
In Vitro
STAT6
Mode of Action: Degrader (PROTAC)
Structure-Activity-Relationship data available? No
DOI Reference: 10.1021/acs.jmedchem.4c01009
Negative Control Compounds
AK-1690me
Notes: AK-1690Me is the negative control, and it does not degrade STAT6
SMILES:
CC(C)([C@@H](C(N1C[C@H](C[C@H]1C(N2CCO[C@@H](C2)c3ccccc3)=O)OCCCCCC#Cc4c(CN(C5=O)[C@@H]6CCC(N(C)C6=O)=O)c5ccc4)=O)NC(c(c7)sc8c7cc(C(F)(P(O)(O)=O)F)cc8)=O)C
Chemical Information
| Molecular Formula | C51H56F2N5O11PS |
| SMILEs | CC(C)(C)[C@H](NC(=O)c1cc2cc(C(F)(F)P(=O)(O)O)ccc2s1)C(=O)N1C[C@@H](OCCCCCC#Cc2cccc3c2CN([C@@H]2CCC(=O)NC2=O)C3=O)C[C@H]1C(=O)N1CCO[C@H](c2ccccc2)C1 |
| InChI | InChI=1S/C51H56F2N5O11PS/c1-50(2,3)44(55-46(61)42-26-33-25-34(18-20-41(33)71-42)51(52,53)70(65,66)67)49(64)57-28-35(27-39(57)48(63)56-22-24-69-40(30-56)32-14-9-7-10-15-32)68-23-11-6-4-5-8-13-31-16-12-17-36-37(31)29-58(47(36)62)38-19-21-43(59)54-45(38)60/h7,9-10,12,14-18,20,25-26,35,38-40,44H,4-6,11,19,21-24,27-30H2,1-3H3,(H,55,61)(H,54,59,60)(H2,65,66,67)/t35-,38+,39-,40-,44+/m0/s1 |
| Molecular weight | 1015.34 Da |
| AlogP | 6.232100000000006 |
| HBond acceptors | 16 |
| HBond donors | 4 |
| Atoms | 127 |