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BDBM164551 US9067871, 38

SMILES: CC(C)(C)OC(=O)NC1CCc2ccc(CN)cc2C1Cc1ccc(Cl)c(Cl)c1

InChI Key: InChIKey=NIWMRCBQHHQCIN-UHFFFAOYNA-N

Data: 1 KI  1 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 = 164551   
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))
BDBM164551
PNG
(US9067871, 38)
Show SMILES CC(C)(C)OC(=O)NC1CCc2ccc(CN)cc2C1Cc1ccc(Cl)c(Cl)c1
Show InChI InChI=1/C23H28Cl2N2O2/c1-23(2,3)29-22(28)27-21-9-7-16-6-4-15(13-26)11-17(16)18(21)10-14-5-8-19(24)20(25)12-14/h4-6,8,11-12,18,21H,7,9-10,13,26H2,1-3H3,(H,27,28)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
<1.00E+5n/an/an/an/an/an/an/an/a



AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding to human GlyT1c transporter-expressing membranes was carried out as described in Mezler et al., Molecular Pharmacology 74:1705-17...


US Patent US9067871 (2015)


BindingDB Entry DOI: 10.7270/Q2HH6HV4
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM164551
PNG
(US9067871, 38)
Show SMILES CC(C)(C)OC(=O)NC1CCc2ccc(CN)cc2C1Cc1ccc(Cl)c(Cl)c1
Show InChI InChI=1/C23H28Cl2N2O2/c1-23(2,3)29-22(28)27-21-9-7-16-6-4-15(13-26)11-17(16)18(21)10-14-5-8-19(24)20(25)12-14/h4-6,8,11-12,18,21H,7,9-10,13,26H2,1-3H3,(H,27,28)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a<1.00E+5n/an/an/an/an/an/a



AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
[3H]-Glycine uptake into recombinant CHO cells expressing human GlyT1: Human GlyT1c expressing recombinant hGlyT1c5_CHO cells were plated at 20,000 c...


US Patent US9067871 (2015)


BindingDB Entry DOI: 10.7270/Q2HH6HV4
More data for this
Ligand-Target Pair