BindingDB logo
myBDB logout

BDBM141184 US8653100, 95

SMILES: CCCS(=O)(=O)NCCOc1ccc2CCNC(c2c1)C1(CCC1)c1cccc(F)c1

InChI Key: InChIKey=LEEGLBMDJSUWBA-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 = 141184   
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))
BDBM141184
PNG
(US8653100, 95)
Show SMILES CCCS(=O)(=O)NCCOc1ccc2CCNC(c2c1)C1(CCC1)c1cccc(F)c1
Show InChI InChI=1S/C24H31FN2O3S/c1-2-15-31(28,29)27-13-14-30-21-8-7-18-9-12-26-23(22(18)17-21)24(10-4-11-24)19-5-3-6-20(25)16-19/h3,5-8,16-17,23,26-27H,2,4,9-15H2,1H3
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
<100n/an/an/an/an/an/a7.5n/a



AbbVie Inc.; 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 US8653100 (2014)


BindingDB Entry DOI: 10.7270/Q2JD4VH9
More data for this
Ligand-Target Pair
Glycine transporter 1


(Homo sapiens (Human))
BDBM141184
PNG
(US8653100, 95)
Show SMILES CCCS(=O)(=O)NCCOc1ccc2CCNC(c2c1)C1(CCC1)c1cccc(F)c1
Show InChI InChI=1S/C24H31FN2O3S/c1-2-15-31(28,29)27-13-14-30-21-8-7-18-9-12-26-23(22(18)17-21)24(10-4-11-24)19-5-3-6-20(25)16-19/h3,5-8,16-17,23,26-27H,2,4,9-15H2,1H3
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a<100n/an/an/an/an/an/a



AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
[3H]-Glycine uptake into recombinant CHO cells expressing human GlyT1: Human GlyT1c expressing recombinant hGlyT1c_5_CHO cells were plated at 20,000 ...


US Patent US8653100 (2014)


BindingDB Entry DOI: 10.7270/Q2JD4VH9
More data for this
Ligand-Target Pair