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SMILES: [NH3+][C@H]1CC(=CC[C@@H]1c1ccccc1Cl)c1ccccc1

InChI Key: InChIKey=XJEZQQZKQBCUQB-AEFFLSMTSA-O

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 12650   
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
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM12650
PNG
((1S,6R)-6-(2-chlorophenyl)-3-phenylcyclohex-3-en-1...)
Show SMILES [NH3+][C@H]1CC(=CC[C@@H]1c1ccccc1Cl)c1ccccc1 |r,c:3|
Show InChI InChI=1S/C18H18ClN/c19-17-9-5-4-8-15(17)16-11-10-14(12-18(16)20)13-6-2-1-3-7-13/h1-10,16,18H,11-12,20H2/p+1/t16-,18+/m1/s1
PDB
MMDB

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PC cid
PC sid
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Article
PubMed
<140<-9.25n/an/an/an/an/a7.522



Abbott Laboratories



Assay Description
The DPP activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 355 nm and meas...


J Med Chem 49: 6439-42 (2006)


Article DOI: 10.1021/jm060955d
BindingDB Entry DOI: 10.7270/Q2G73BXR
More data for this
Ligand-Target Pair