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2 similar compounds to monomer 30712

Compile data set for download or QSAR
Wt: 204.2
BDBM50064815
Wt: 204.2
BDBM50064804

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50064815,50064804   
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 1D


(Homo sapiens (human))
BDBM50064815
PNG
(3-(4,5-Dihydro-1H-imidazol-2-ylmethyl)-2,4-dimethy...)
Show SMILES Cc1ccc(O)c(C)c1CC1=NCCN1
Show InChI InChI=1S/C12H16N2O/c1-8-3-4-11(15)9(2)10(8)7-12-13-5-6-14-12/h3-4,15H,5-7H2,1-2H3,(H,13,14)
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Article
PubMed
1.04E+3n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Binding affinity towards human 5-hydroxytryptamine 1D receptor using [3H]-5-HT trifluoroacetate as radioligand


J Med Chem 41: 2243-51 (1998)


Article DOI: 10.1021/jm970513p
BindingDB Entry DOI: 10.7270/Q28K7872
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1D


(Homo sapiens (human))
BDBM50064804
PNG
(3-(4,5-Dihydro-1H-imidazol-2-ylmethyl)-2,6-dimethy...)
Show SMILES Cc1ccc(CC2=NCCN2)c(C)c1O
Show InChI InChI=1S/C12H16N2O/c1-8-3-4-10(9(2)12(8)15)7-11-13-5-6-14-11/h3-4,15H,5-7H2,1-2H3,(H,13,14)
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Article
PubMed
1.90E+3n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Binding affinity towards human 5-hydroxytryptamine 1D receptor using [3H]-5-HT trifluoroacetate as radioligand


J Med Chem 41: 2243-51 (1998)


Article DOI: 10.1021/jm970513p
BindingDB Entry DOI: 10.7270/Q28K7872
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1B


(Homo sapiens (human))
BDBM50064804
PNG
(3-(4,5-Dihydro-1H-imidazol-2-ylmethyl)-2,6-dimethy...)
Show SMILES Cc1ccc(CC2=NCCN2)c(C)c1O
Show InChI InChI=1S/C12H16N2O/c1-8-3-4-10(9(2)12(8)15)7-11-13-5-6-14-11/h3-4,15H,5-7H2,1-2H3,(H,13,14)
PDB

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Article
PubMed
2.00E+3n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Binding affinity towards human 5-hydroxytryptamine 1B receptor using [3H]-5-HT trifluoroacetate as radioligand


J Med Chem 41: 2243-51 (1998)


Article DOI: 10.1021/jm970513p
BindingDB Entry DOI: 10.7270/Q28K7872
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1B


(Homo sapiens (human))
BDBM50064815
PNG
(3-(4,5-Dihydro-1H-imidazol-2-ylmethyl)-2,4-dimethy...)
Show SMILES Cc1ccc(O)c(C)c1CC1=NCCN1
Show InChI InChI=1S/C12H16N2O/c1-8-3-4-11(15)9(2)10(8)7-12-13-5-6-14-12/h3-4,15H,5-7H2,1-2H3,(H,13,14)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
5.79E+3n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Binding affinity towards human 5-hydroxytryptamine 1B receptor using [3H]-5-HT trifluoroacetate as radioligand


J Med Chem 41: 2243-51 (1998)


Article DOI: 10.1021/jm970513p
BindingDB Entry DOI: 10.7270/Q28K7872
More data for this
Ligand-Target Pair