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BDBM209027 US9243038, 3b (trans olefin)

SMILES: NC(=O)[C@@H]1CCCCNC(=O)[C@@H](Cc2ccc(cc2)C(=O)c2ccccc2)NC(=O)[C@H](CC2CCCCC2)NC(=O)C[C@@H](O)[C@H](CC2CCCCC2)NC(=O)\C=C\C(=O)N1

InChI Key: InChIKey=ZUCWCMQJSSLFDY-HMJFQPJTSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 209027   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/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))
BDBM209027
PNG
(US9243038, 3b (trans olefin))
Show SMILES NC(=O)[C@@H]1CCCCNC(=O)[C@@H](Cc2ccc(cc2)C(=O)c2ccccc2)NC(=O)[C@H](CC2CCCCC2)NC(=O)C[C@@H](O)[C@H](CC2CCCCC2)NC(=O)\C=C\C(=O)N1
Show InChI InChI=1S/C46H62N6O8/c47-44(58)35-18-10-11-25-48-45(59)37(28-32-19-21-34(22-20-32)43(57)33-16-8-3-9-17-33)52-46(60)38(27-31-14-6-2-7-15-31)51-42(56)29-39(53)36(26-30-12-4-1-5-13-30)50-41(55)24-23-40(54)49-35/h3,8-9,16-17,19-24,30-31,35-39,53H,1-2,4-7,10-15,18,25-29H2,(H2,47,58)(H,48,59)(H,49,54)(H,50,55)(H,51,56)(H,52,60)/b24-23+/t35-,36-,37+,38-,39+/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 1.50E+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