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BDBM50435558 CHEMBL2392814

SMILES: Cc1cncn1CCCNC(=S)Nc1ccc2OCCCc2c1

InChI Key: InChIKey=DCVTVEULPLNXDM-UHFFFAOYSA-N

Data: 1 IC50

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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 = 50435558   
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
Glutaminyl Cyclase


(Homo sapiens (Human))
BDBM50435558
PNG
(CHEMBL2392814)
Show SMILES Cc1cncn1CCCNC(=S)Nc1ccc2OCCCc2c1
Show InChI InChI=1S/C17H22N4OS/c1-13-11-18-12-21(13)8-3-7-19-17(23)20-15-5-6-16-14(10-15)4-2-9-22-16/h5-6,10-12H,2-4,7-9H2,1H3,(H2,19,20,23)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 208n/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Inhibition of human glutaminyl cyclase expressed in HEK293 cells using L-glutaminyl-beta-naphthylamine as substrate after 1 hr by fluorometric analys...


Bioorg Med Chem 21: 3821-30 (2013)


Article DOI: 10.1016/j.bmc.2013.04.005
BindingDB Entry DOI: 10.7270/Q2BR8TJF
More data for this
Ligand-Target Pair