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BDBM164548 US9067871, 36

SMILES: CC(C)(C)OC(=O)NC1CCc2ccc(OC(F)F)cc2C1Cc1ccc(Cl)cc1

InChI Key: InChIKey=XQDWXUDIDYCQIB-UHFFFAOYSA-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 = 164548   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Glycine transporter 1


(Homo sapiens (Human))
BDBM164548
PNG
(US9067871, 36)
Show SMILES CC(C)(C)OC(=O)NC1CCc2ccc(OC(F)F)cc2C1Cc1ccc(Cl)cc1
Show InChI InChI=1S/C23H26ClF2NO3/c1-23(2,3)30-22(28)27-20-11-7-15-6-10-17(29-21(25)26)13-18(15)19(20)12-14-4-8-16(24)9-5-14/h4-6,8-10,13,19-21H,7,11-12H2,1-3H3,(H,27,28)
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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))
BDBM164548
PNG
(US9067871, 36)
Show SMILES CC(C)(C)OC(=O)NC1CCc2ccc(OC(F)F)cc2C1Cc1ccc(Cl)cc1
Show InChI InChI=1S/C23H26ClF2NO3/c1-23(2,3)30-22(28)27-20-11-7-15-6-10-17(29-21(25)26)13-18(15)19(20)12-14-4-8-16(24)9-5-14/h4-6,8-10,13,19-21H,7,11-12H2,1-3H3,(H,27,28)
PDB

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KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a<1.00E+4n/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