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BDBM50367508 CHEMBL1907817

SMILES: CC(=O)NC(CSCCCC\C=C(/NC(=O)[C@H]1CC1(C)C)C(O)=O)C([O-])=O

InChI Key: InChIKey=SEQPPJZLZIXXRN-KNLNLFHQSA-M

Data: 1 KI

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50367508   
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
Renal dipeptidase


(GUINEA PIG)
BDBM50367508
PNG
(CHEMBL1907817)
Show SMILES CC(=O)NC(CSCCCC\C=C(/NC(=O)[C@H]1CC1(C)C)C(O)=O)C([O-])=O |r|
Show InChI InChI=1S/C18H28N2O6S/c1-11(21)19-14(17(25)26)10-27-8-6-4-5-7-13(16(23)24)20-15(22)12-9-18(12,2)3/h7,12,14H,4-6,8-10H2,1-3H3,(H,19,21)(H,20,22)(H,23,24)(H,25,26)/p-1/b13-7-/t12-,14?/m1/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem
PubMed
60n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against beta-lactamase renal dipeptidase


J Med Chem 30: 1074-90 (1987)


BindingDB Entry DOI: 10.7270/Q2F47PQC
More data for this
Ligand-Target Pair