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BDBM50423232 CHEMBL391297

SMILES: CC(C)CC1CCCN1C[C@@H](O)CNS(=O)(=O)c1cccc2ccccc12

InChI Key: InChIKey=OKVHTTCXTTYJSU-GGYWPGCISA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50423232   
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))
BDBM50423232
PNG
(CHEMBL391297)
Show SMILES CC(C)CC1CCCN1C[C@@H](O)CNS(=O)(=O)c1cccc2ccccc12
Show InChI InChI=1S/C21H30N2O3S/c1-16(2)13-18-9-6-12-23(18)15-19(24)14-22-27(25,26)21-11-5-8-17-7-3-4-10-20(17)21/h3-5,7-8,10-11,16,18-19,22,24H,6,9,12-15H2,1-2H3/t18?,19-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.51E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake in human GlyT1c expressed in HEK293 cells


Bioorg Med Chem Lett 17: 1741-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.063
BindingDB Entry DOI: 10.7270/Q29W0GSG
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM50423232
PNG
(CHEMBL391297)
Show SMILES CC(C)CC1CCCN1C[C@@H](O)CNS(=O)(=O)c1cccc2ccccc12
Show InChI InChI=1S/C21H30N2O3S/c1-16(2)13-18-9-6-12-23(18)15-19(24)14-22-27(25,26)21-11-5-8-17-7-3-4-10-20(17)21/h3-5,7-8,10-11,16,18-19,22,24H,6,9,12-15H2,1-2H3/t18?,19-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.51E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake in human GlyT1c expressed in HEK293 cells


Bioorg Med Chem Lett 17: 1741-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.063
BindingDB Entry DOI: 10.7270/Q29W0GSG
More data for this
Ligand-Target Pair