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SMILES: COc1ccc(cc1N1CCN(CCN2C(c3ccc(I)cc3C2=O)c2ccccc2)CC1)[N+]([O-])=O

InChI Key: InChIKey=AJADRZYCQRMFGP-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50062272   
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))		BDBM50062272
PNG
(6-Iodo-2-{2-[4-(2-methoxy-5-nitro-phenyl)-piperazi...)
Show SMILES COc1ccc(cc1N1CCN(CCN2C(c3ccc(I)cc3C2=O)c2ccccc2)CC1)[N+]([O-])=O
Show InChI InChI=1S/C27H27IN4O4/c1-36-25-10-8-21(32(34)35)18-24(25)30-14-11-29(12-15-30)13-16-31-26(19-5-3-2-4-6-19)22-9-7-20(28)17-23(22)27(31)33/h2-10,17-18,26H,11-16H2,1H3
PDB

KEGG

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
 51.7n/an/an/an/an/an/an/an/a



University of Pennsylvania

Curated by ChEMBL


Assay Description
In vitro binding affinity for 5-hydroxytryptamine 1A receptor in rat hippocampal membranes by [125I]-labeled agonist displacement.

J Med Chem 41: 157-66 (1998)


Article DOI: 10.1021/jm970296s
BindingDB Entry DOI: 10.7270/Q2TX3DH6
More data for this
Ligand-Target Pair