BDBM50172879 (S)-2-(3-Piperidin-1-yl-propyl)-10,10a-dihydro-5H-imidazo[1,5-b]isoquinoline-1,3-dione::CHEMBL381653

SMILES: Oc1c2Cc3ccccc3Cn2c(=O)n1CCCN1CCCCC1

InChI Key: InChIKey=XHTSYUGYMGZJHN-UHFFFAOYSA-N

Data: 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 2 hits for monomerid = 50172879   

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
Sigma non-opioid intracellular receptor 1 (Homo sapiens (Human))	BDBM50172879 ((S)-2-(3-Piperidin-1-yl-propyl)-10,10a-dihydro-5H-...) Show SMILES Oc1c2Cc3ccccc3Cn2c(=O)n1CCCN1CCCCC1 Show InChI InChI=1S/C19H25N3O2/c23-18-17-13-15-7-2-3-8-16(15)14-22(17)19(24)21(18)12-6-11-20-9-4-1-5-10-20/h2-3,7-8,23H,1,4-6,9-14H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	21.5	n/a	n/a	n/a	n/a	n/a	n/a
Université de Lille II Curated by ChEMBL					Assay Description Inhibitory concentration against opioid receptor sigma 1 of guinea pig cerebral cortex using [3H]-(+)-pentazocine upon incubation for 150 minutes at ...				Bioorg Med Chem Lett 15: 4833-7 (2005) Article DOI: 10.1016/j.bmcl.2005.07.040 BindingDB Entry DOI: 10.7270/Q2PN9553
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Homo sapiens (Human))	BDBM50172879 ((S)-2-(3-Piperidin-1-yl-propyl)-10,10a-dihydro-5H-...) Show SMILES Oc1c2Cc3ccccc3Cn2c(=O)n1CCCN1CCCCC1 Show InChI InChI=1S/C19H25N3O2/c23-18-17-13-15-7-2-3-8-16(15)14-22(17)19(24)21(18)12-6-11-20-9-4-1-5-10-20/h2-3,7-8,23H,1,4-6,9-14H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	21.5	n/a	n/a	n/a	n/a	7.5	n/a
Université de Lille II Curated by ChEMBL					Assay Description Inhibitory activity against opioid receptor sigma 1 in guinea pig cerebral cortex using [3H]-(+)-pentazocine as radio ligand at pH 7.5 for 150 min at...				Bioorg Med Chem Lett 15: 4828-32 (2005) Article DOI: 10.1016/j.bmcl.2005.07.039 BindingDB Entry DOI: 10.7270/Q2TD9WW1
					More data for this Ligand-Target Pair