BDBM50007176 2-{4-[4-(2-Nitro-phenyl)-piperazin-1-yl]-butyl}-isoindole-1,3-dione::CHEMBL26189

SMILES: [O-][N+](=O)c1ccccc1N1CCN(CCCCN2C(=O)c3ccccc3C2=O)CC1

InChI Key: InChIKey=QQUOTHVRTXIZGH-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50007176   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50007176 (2-{4-[4-(2-Nitro-phenyl)-piperazin-1-yl]-butyl}-is...) Show SMILES [O-][N+](=O)c1ccccc1N1CCN(CCCCN2C(=O)c3ccccc3C2=O)CC1 Show InChI InChI=1S/C22H24N4O4/c27-21-17-7-1-2-8-18(17)22(28)25(21)12-6-5-11-23-13-15-24(16-14-23)19-9-3-4-10-20(19)26(29)30/h1-4,7-10H,5-6,11-16H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Virginia Commonwealth University Curated by ChEMBL					Assay Description Binding affinity towards 5-hydroxytryptamine 1A receptor of rat hippocampus using [3H]-8-hydroxy-2-(di-n-propylamine) tetralin (8-OH-DPAT) as a radio...				J Med Chem 34: 2633-8 (1991) BindingDB Entry DOI: 10.7270/Q2833R0C
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50007176 (2-{4-[4-(2-Nitro-phenyl)-piperazin-1-yl]-butyl}-is...) Show SMILES [O-][N+](=O)c1ccccc1N1CCN(CCCCN2C(=O)c3ccccc3C2=O)CC1 Show InChI InChI=1S/C22H24N4O4/c27-21-17-7-1-2-8-18(17)22(28)25(21)12-6-5-11-23-13-15-24(16-14-23)19-9-3-4-10-20(19)26(29)30/h1-4,7-10H,5-6,11-16H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Lausanne Curated by ChEMBL					Assay Description Binding affinity of a compound to rat brain 5-hydroxytryptamine 1A (serotonin) receptor assayed by radiolabeled [3H]-8-OH-DPAT ligand displacement				J Med Chem 39: 126-34 (1996) Article DOI: 10.1021/jm950410b BindingDB Entry DOI: 10.7270/Q2VX0K7V
					More data for this Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor (Rattus norvegicus (rat)-Rattus norvegicus (Rat))	BDBM50007176 (2-{4-[4-(2-Nitro-phenyl)-piperazin-1-yl]-butyl}-is...) Show SMILES [O-][N+](=O)c1ccccc1N1CCN(CCCCN2C(=O)c3ccccc3C2=O)CC1 Show InChI InChI=1S/C22H24N4O4/c27-21-17-7-1-2-8-18(17)22(28)25(21)12-6-5-11-23-13-15-24(16-14-23)19-9-3-4-10-20(19)26(29)30/h1-4,7-10H,5-6,11-16H2	Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	25	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Virginia Commonwealth University Curated by ChEMBL					Assay Description Binding affinity towards alpha-1 adrenergic receptor of rat frontal cortex using [3H]- WB- 4101 as a radioligand				J Med Chem 34: 2633-8 (1991) BindingDB Entry DOI: 10.7270/Q2833R0C
					More data for this Ligand-Target Pair