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Compile Data Set for Download or QSAR

Found 3 hits of ki for monomerid = 50408703   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
5-hydroxytryptamine receptor 1B


(Homo sapiens (Human))
BDBM50408703
PNG
(CHEMBL277467)
Show SMILES COc1ccc(NC(=O)c2ccc(Br)c(C)c2)cc1N1CCN(C)CC1
Show InChI InChI=1S/C20H24BrN3O2/c1-14-12-15(4-6-17(14)21)20(25)22-16-5-7-19(26-3)18(13-16)24-10-8-23(2)9-11-24/h4-7,12-13H,8-11H2,1-3H3,(H,22,25)
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PC sid
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6.31n/an/an/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity for human 5-hydroxytryptamine 1B receptor


J Med Chem 41: 1218-35 (1998)


Article DOI: 10.1021/jm970457s
BindingDB Entry DOI: 10.7270/Q2XS5WMN
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1D


(Homo sapiens (Human))
BDBM50408703
PNG
(CHEMBL277467)
Show SMILES COc1ccc(NC(=O)c2ccc(Br)c(C)c2)cc1N1CCN(C)CC1
Show InChI InChI=1S/C20H24BrN3O2/c1-14-12-15(4-6-17(14)21)20(25)22-16-5-7-19(26-3)18(13-16)24-10-8-23(2)9-11-24/h4-7,12-13H,8-11H2,1-3H3,(H,22,25)
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12.6n/an/an/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity for human 5-hydroxytryptamine 1D receptor


J Med Chem 41: 1218-35 (1998)


Article DOI: 10.1021/jm970457s
BindingDB Entry DOI: 10.7270/Q2XS5WMN
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50408703
PNG
(CHEMBL277467)
Show SMILES COc1ccc(NC(=O)c2ccc(Br)c(C)c2)cc1N1CCN(C)CC1
Show InChI InChI=1S/C20H24BrN3O2/c1-14-12-15(4-6-17(14)21)20(25)22-16-5-7-19(26-3)18(13-16)24-10-8-23(2)9-11-24/h4-7,12-13H,8-11H2,1-3H3,(H,22,25)
PDB
MMDB

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antibodypedia
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PC cid
PC sid
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Article
PubMed
200n/an/an/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity for human 5-hydroxytryptamine 2A receptor


J Med Chem 41: 1218-35 (1998)


Article DOI: 10.1021/jm970457s
BindingDB Entry DOI: 10.7270/Q2XS5WMN
More data for this
Ligand-Target Pair