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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'insulin-degrading enzyme isoform 1 precursor' and Ligand = 'BDBM209050'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
insulin-degrading enzyme isoform 1 precursor


(Homo sapiens (Human))
BDBM209050
PNG
(US9243038, 25)
Show SMILES NC(=O)CC[C@@H]1NC(=O)\C=C/C(=O)NNCCCC(NCCCCNC(=O)[C@@H](Cc2ccc(cc2)C(=O)c2ccccc2)NC(=O)[C@H](CC2CCCCC2)NC1=O)C(N)=O
Show InChI InChI=1S/C43H59N9O8/c44-36(53)20-19-33-42(59)51-35(26-28-10-3-1-4-11-28)43(60)50-34(27-29-15-17-31(18-16-29)39(56)30-12-5-2-6-13-30)41(58)47-24-8-7-23-46-32(40(45)57)14-9-25-48-52-38(55)22-21-37(54)49-33/h2,5-6,12-13,15-18,21-22,28,32-35,46,48H,1,3-4,7-11,14,19-20,23-27H2,(H2,44,53)(H2,45,57)(H,47,58)(H,49,54)(H,50,60)(H,51,59)(H,52,55)/b22-21-/t32?,33-,34+,35-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 5.00E+3n/an/an/an/an/an/a



President and Fellows of Harvard College

US Patent


Assay Description
Macrocycles were assayed for IDE inhibition by monitoring cleavage of a substrate peptide containing a fluorophore-quencher pair such that cleavage o...


US Patent US9243038 (2016)


BindingDB Entry DOI: 10.7270/Q2MW2FZV
More data for this
Ligand-Target Pair