BDBM50000606 2-Phenyl-6-[6-(2-pyrimidin-2-yl-piperazin-1-yl)-hexyloxy]-chromen-4-one::CHEMBL39584

SMILES: O=c1cc(oc2ccc(OCCCCCCN3CCNCC3c3ncccn3)cc12)-c1ccccc1

InChI Key: InChIKey=IMSBLSSUHKSGTN-UHFFFAOYSA-N

Data: 1 KI  2 IC50

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 = 50000606   

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
D(2) dopamine receptor (Rattus norvegicus (rat))	BDBM50000606 (2-Phenyl-6-[6-(2-pyrimidin-2-yl-piperazin-1-yl)-he...) Show SMILES O=c1cc(oc2ccc(OCCCCCCN3CCNCC3c3ncccn3)cc12)-c1ccccc1 Show InChI InChI=1S/C29H32N4O3/c34-26-20-28(22-9-4-3-5-10-22)36-27-12-11-23(19-24(26)27)35-18-7-2-1-6-16-33-17-15-30-21-25(33)29-31-13-8-14-32-29/h3-5,8-14,19-20,25,30H,1-2,6-7,15-18,21H2	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Nova Pharmaceutical Corporation Curated by ChEMBL					Assay Description Affinity towards dopamine receptor D2 was determined by competition studies using [3H]-sulpiride in rat striatum.				J Med Chem 35: 1526-35 (1992) BindingDB Entry DOI: 10.7270/Q2XG9Q38
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Homo sapiens (Human))	BDBM50000606 (2-Phenyl-6-[6-(2-pyrimidin-2-yl-piperazin-1-yl)-he...) Show SMILES O=c1cc(oc2ccc(OCCCCCCN3CCNCC3c3ncccn3)cc12)-c1ccccc1 Show InChI InChI=1S/C29H32N4O3/c34-26-20-28(22-9-4-3-5-10-22)36-27-12-11-23(19-24(26)27)35-18-7-2-1-6-16-33-17-15-30-21-25(33)29-31-13-8-14-32-29/h3-5,8-14,19-20,25,30H,1-2,6-7,15-18,21H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.42E+4	n/a	n/a	n/a	n/a	n/a	n/a
Nova Pharmaceutical Corporation Curated by ChEMBL					Assay Description Potency at the sigma binding site was determined in radioligand				J Med Chem 35: 1526-35 (1992) BindingDB Entry DOI: 10.7270/Q2XG9Q38
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Homo sapiens (Human))	BDBM50000606 (2-Phenyl-6-[6-(2-pyrimidin-2-yl-piperazin-1-yl)-he...) Show SMILES O=c1cc(oc2ccc(OCCCCCCN3CCNCC3c3ncccn3)cc12)-c1ccccc1 Show InChI InChI=1S/C29H32N4O3/c34-26-20-28(22-9-4-3-5-10-22)36-27-12-11-23(19-24(26)27)35-18-7-2-1-6-16-33-17-15-30-21-25(33)29-31-13-8-14-32-29/h3-5,8-14,19-20,25,30H,1-2,6-7,15-18,21H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.63E+3	n/a	n/a	n/a	n/a	n/a	n/a
Nova Pharmaceutical Corporation Curated by ChEMBL					Assay Description Potency at the sigma binding site was determined in radioligand				J Med Chem 35: 1526-35 (1992) BindingDB Entry DOI: 10.7270/Q2XG9Q38
					More data for this Ligand-Target Pair