BDBM312201 US9604926, Compound CM-396::US9724435, Compound CM-396

SMILES: Cn1c2ccccc2n(CCCCN2CCN(CC2)C2CCCCC2)c1=O

InChI Key: InChIKey=WSCMDSDVNPOTBT-UHFFFAOYSA-N

Data: 6 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 6 hits for monomerid = 312201   

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-2 receptor (Rattus norvegicus (Rat))	BDBM312201 (US9604926, Compound CM-396 | US9724435, Compound C...) Show SMILES Cn1c2ccccc2n(CCCCN2CCN(CC2)C2CCCCC2)c1=O Show InChI InChI=1S/C22H34N4O/c1-23-20-11-5-6-12-21(20)26(22(23)27)14-8-7-13-24-15-17-25(18-16-24)19-9-3-2-4-10-19/h5-6,11-12,19H,2-4,7-10,13-18H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	2.57	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
THE UNIVERSITY OF MISSISSIPPI; THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY US Patent					Assay Description Compounds were evaluated for σ-1 and σ-2 binding in rat brain homogenates. Twelve concentrations of each test ligand (0.001-1,000 nM) were ...				US Patent US9724435 (2017) BindingDB Entry DOI: 10.7270/Q2BZ6856
					More data for this Ligand-Target Pair
Sigma intracellular receptor 2 (Mus musculus (Mouse))	BDBM312201 (US9604926, Compound CM-396 | US9724435, Compound C...) Show SMILES Cn1c2ccccc2n(CCCCN2CCN(CC2)C2CCCCC2)c1=O Show InChI InChI=1S/C22H34N4O/c1-23-20-11-5-6-12-21(20)26(22(23)27)14-8-7-13-24-15-17-25(18-16-24)19-9-3-2-4-10-19/h5-6,11-12,19H,2-4,7-10,13-18H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	2.57	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
THE UNIVERSITY OF MISSISSIPPI US Patent					Assay Description Compounds were evaluated for σ-1 and σ-2 binding in rat brain homogenates. Twelve concentrations of each test ligand (0.001-1,000 nM) were ...				US Patent US9604926 (2017) BindingDB Entry DOI: 10.7270/Q27D2X6J
					More data for this Ligand-Target Pair
Sigma intracellular receptor 2 (Rattus norvegicus (Rat))	BDBM312201 (US9604926, Compound CM-396 | US9724435, Compound C...) Show SMILES Cn1c2ccccc2n(CCCCN2CCN(CC2)C2CCCCC2)c1=O Show InChI InChI=1S/C22H34N4O/c1-23-20-11-5-6-12-21(20)26(22(23)27)14-8-7-13-24-15-17-25(18-16-24)19-9-3-2-4-10-19/h5-6,11-12,19H,2-4,7-10,13-18H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Florida Curated by ChEMBL					Assay Description Displacement of [3H]-DTG from sigma2 receptor in rat brain membranes after 120 mins in presence of (+)-pentazocine by radioligand binding assay				Eur J Med Chem 165: 250-257 (2019) Article DOI: 10.1016/j.ejmech.2019.01.019
					More data for this Ligand-Target Pair
Sigma opioid receptor (RAT)	BDBM312201 (US9604926, Compound CM-396 | US9724435, Compound C...) Show SMILES Cn1c2ccccc2n(CCCCN2CCN(CC2)C2CCCCC2)c1=O Show InChI InChI=1S/C22H34N4O/c1-23-20-11-5-6-12-21(20)26(22(23)27)14-8-7-13-24-15-17-25(18-16-24)19-9-3-2-4-10-19/h5-6,11-12,19H,2-4,7-10,13-18H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	50	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Florida Curated by ChEMBL					Assay Description Displacement of [3H](+)-pentazocine from sigma1 receptor in rat brain membranes after 120 mins by radioligand binding assay				Eur J Med Chem 165: 250-257 (2019) Article DOI: 10.1016/j.ejmech.2019.01.019
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (RAT)	BDBM312201 (US9604926, Compound CM-396 | US9724435, Compound C...) Show SMILES Cn1c2ccccc2n(CCCCN2CCN(CC2)C2CCCCC2)c1=O Show InChI InChI=1S/C22H34N4O/c1-23-20-11-5-6-12-21(20)26(22(23)27)14-8-7-13-24-15-17-25(18-16-24)19-9-3-2-4-10-19/h5-6,11-12,19H,2-4,7-10,13-18H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	50.2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
THE UNIVERSITY OF MISSISSIPPI; THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY US Patent					Assay Description Compounds were evaluated for σ-1 and σ-2 binding in rat brain homogenates. Twelve concentrations of each test ligand (0.001-1,000 nM) were ...				US Patent US9724435 (2017) BindingDB Entry DOI: 10.7270/Q2BZ6856
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Mus musculus (Mouse))	BDBM312201 (US9604926, Compound CM-396 | US9724435, Compound C...) Show SMILES Cn1c2ccccc2n(CCCCN2CCN(CC2)C2CCCCC2)c1=O Show InChI InChI=1S/C22H34N4O/c1-23-20-11-5-6-12-21(20)26(22(23)27)14-8-7-13-24-15-17-25(18-16-24)19-9-3-2-4-10-19/h5-6,11-12,19H,2-4,7-10,13-18H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	50.2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
THE UNIVERSITY OF MISSISSIPPI US Patent					Assay Description Compounds were evaluated for σ-1 and σ-2 binding in rat brain homogenates. Twelve concentrations of each test ligand (0.001-1,000 nM) were ...				US Patent US9604926 (2017) BindingDB Entry DOI: 10.7270/Q27D2X6J
					More data for this Ligand-Target Pair