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BDBM50368784 CHEMBL4173117

SMILES: CCCCS(=O)(=O)NCCOc1ccc2CC[C@H](N)[C@H](Cc3ccc(Cl)c(Cl)c3)c2c1

InChI Key: InChIKey=NDKRNZIJRIZOLY-OFNKIYASSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50368784   
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))		BDBM50368784
PNG
(CHEMBL4173117)
Show SMILES CCCCS(=O)(=O)NCCOc1ccc2CC[C@H](N)[C@H](Cc3ccc(Cl)c(Cl)c3)c2c1 |r|
Show InChI InChI=1S/C23H30Cl2N2O3S/c1-2-3-12-31(28,29)27-10-11-30-18-7-5-17-6-9-23(26)20(19(17)15-18)13-16-4-8-21(24)22(25)14-16/h4-5,7-8,14-15,20,23,27H,2-3,6,9-13,26H2,1H3/t20-,23+/m1/s1
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Similars
Article
PubMed
 136n/an/an/an/an/an/an/an/a



AbbVie Deutschland GmbH & Co. KG

Curated by ChEMBL


Assay Description
Displacement of [3H]N-Methyl-SSR504734 from human GlyT1c expressed in cell membranes incubated for 1 hr by liquid scintillation spectrometry

J Med Chem 61: 7503-7524 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00300
BindingDB Entry DOI: 10.7270/Q2W66P9B
More data for this
Ligand-Target Pair