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BDBM50186242 (S)-N-(1-(4-(4-(2-methoxyphenyl)piperazin-1-yl)butyl)-2,5-dioxopyrrolidin-3-yl)acetamide::CHEMBL210157

SMILES: COc1ccccc1N1CCN(CCCCN2C(=O)C[C@H](NC(C)=O)C2=O)CC1

InChI Key: InChIKey=GKLSRXWQPMCFDA-KRWDZBQOSA-N

Data: 2 KI

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 = 50186242   
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
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50186242
PNG
((S)-N-(1-(4-(4-(2-methoxyphenyl)piperazin-1-yl)but...)
Show SMILES COc1ccccc1N1CCN(CCCCN2C(=O)C[C@H](NC(C)=O)C2=O)CC1 |r|
Show InChI InChI=1S/C21H30N4O4/c1-16(26)22-17-15-20(27)25(21(17)28)10-6-5-9-23-11-13-24(14-12-23)18-7-3-4-8-19(18)29-2/h3-4,7-8,17H,5-6,9-15H2,1-2H3,(H,22,26)/t17-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
69n/an/an/an/an/an/an/an/a



Jagiellonian University Medical College

Curated by ChEMBL


Assay Description
Displacement of [3H]8-OH-DPAT from 5HT1A receptor in rat hippocampal membrane


Eur J Med Chem 44: 800-8 (2009)


Article DOI: 10.1016/j.ejmech.2008.05.021
BindingDB Entry DOI: 10.7270/Q20Z7468
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50186242
PNG
((S)-N-(1-(4-(4-(2-methoxyphenyl)piperazin-1-yl)but...)
Show SMILES COc1ccccc1N1CCN(CCCCN2C(=O)C[C@H](NC(C)=O)C2=O)CC1 |r|
Show InChI InChI=1S/C21H30N4O4/c1-16(26)22-17-15-20(27)25(21(17)28)10-6-5-9-23-11-13-24(14-12-23)18-7-3-4-8-19(18)29-2/h3-4,7-8,17H,5-6,9-15H2,1-2H3,(H,22,26)/t17-/m0/s1
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
69n/an/an/an/an/an/an/an/a



Université Montpellier I et II

Curated by ChEMBL


Assay Description
Affinity for 5HT1A receptor


Bioorg Med Chem Lett 16: 3406-10 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.035
BindingDB Entry DOI: 10.7270/Q2542N6V
More data for this
Ligand-Target Pair