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BDBM50277944 2,4-dichloro-N-((3-(cyclopropylmethyl)-1-(1-ethyl-1H-1,2,3-triazol-4-ylsulfonyl)azetidin-3-yl)methyl)benzamide::CHEMBL483344

SMILES: CCn1cc(nn1)S(=O)(=O)N1CC(CNC(=O)c2ccc(Cl)cc2Cl)(CC2CC2)C1

InChI Key: InChIKey=XIZPVHWTMPFRPB-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50277944   
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
Glycine transporter 1


(Homo sapiens (Human))
BDBM50277944
PNG
(2,4-dichloro-N-((3-(cyclopropylmethyl)-1-(1-ethyl-...)
Show SMILES CCn1cc(nn1)S(=O)(=O)N1CC(CNC(=O)c2ccc(Cl)cc2Cl)(CC2CC2)C1
Show InChI InChI=1S/C19H23Cl2N5O3S/c1-2-25-9-17(23-24-25)30(28,29)26-11-19(12-26,8-13-3-4-13)10-22-18(27)15-6-5-14(20)7-16(15)21/h5-7,9,13H,2-4,8,10-12H2,1H3,(H,22,27)
PDB

KEGG

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PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 2.60n/an/an/an/an/an/a



Merck Sharp and Dohme

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake at human glycine transporter 1 expressed in human JAR cells after 3 hrs by scintillation counting


Bioorg Med Chem Lett 19: 2235-9 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.102
BindingDB Entry DOI: 10.7270/Q23R0SSZ
More data for this
Ligand-Target Pair