BDBM50493000 CHEMBL2413878

SMILES: CN(CCCc1ccccc1)[C@H]1CCCC[C@@H]1O

InChI Key: InChIKey=JGCZBDZBMDXUDD-HOTGVXAUSA-N

Data: 4 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 4 hits for monomerid = 50493000   

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 opioid receptor (RAT)	BDBM50493000 (CHEMBL2413878) Show SMILES CN(CCCc1ccccc1)[C@H]1CCCC[C@@H]1O |r| Show InChI InChI=1S/C16H25NO/c1-17(15-11-5-6-12-16(15)18)13-7-10-14-8-3-2-4-9-14/h2-4,8-9,15-16,18H,5-7,10-13H2,1H3/t15-,16-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	19	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Maryland Curated by ChEMBL					Assay Description Displacement of [3H](+)-pentazocine from sigma 1 receptor in rat brain homogenates after 120 mins by liquid scintillation counting				Bioorg Med Chem 21: 4923-7 (2013) Article DOI: 10.1016/j.bmc.2013.06.068 BindingDB Entry DOI: 10.7270/Q2TM7F26
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50493000 (CHEMBL2413878) Show SMILES CN(CCCc1ccccc1)[C@H]1CCCC[C@@H]1O |r| Show InChI InChI=1S/C16H25NO/c1-17(15-11-5-6-12-16(15)18)13-7-10-14-8-3-2-4-9-14/h2-4,8-9,15-16,18H,5-7,10-13H2,1H3/t15-,16-/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Maryland Curated by ChEMBL					Assay Description Displacement of [3H]DAMGO from human mu opioid receptor expressed in CHO cells after 120 mins by liquid scintillation counting				Bioorg Med Chem 21: 4923-7 (2013) Article DOI: 10.1016/j.bmc.2013.06.068 BindingDB Entry DOI: 10.7270/Q2TM7F26
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50493000 (CHEMBL2413878) Show SMILES CN(CCCc1ccccc1)[C@H]1CCCC[C@@H]1O |r| Show InChI InChI=1S/C16H25NO/c1-17(15-11-5-6-12-16(15)18)13-7-10-14-8-3-2-4-9-14/h2-4,8-9,15-16,18H,5-7,10-13H2,1H3/t15-,16-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Maryland Curated by ChEMBL					Assay Description Displacement of [3H]U69,593 from human kappa opioid receptor expressed in CHO cells after 120 mins by liquid scintillation counting				Bioorg Med Chem 21: 4923-7 (2013) Article DOI: 10.1016/j.bmc.2013.06.068 BindingDB Entry DOI: 10.7270/Q2TM7F26
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50493000 (CHEMBL2413878) Show SMILES CN(CCCc1ccccc1)[C@H]1CCCC[C@@H]1O |r| Show InChI InChI=1S/C16H25NO/c1-17(15-11-5-6-12-16(15)18)13-7-10-14-8-3-2-4-9-14/h2-4,8-9,15-16,18H,5-7,10-13H2,1H3/t15-,16-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Maryland Curated by ChEMBL					Assay Description Displacement of [3H]DPDPE from human delta opioid receptor expressed in CHO cells after 120 mins by liquid scintillation counting				Bioorg Med Chem 21: 4923-7 (2013) Article DOI: 10.1016/j.bmc.2013.06.068 BindingDB Entry DOI: 10.7270/Q2TM7F26
					More data for this Ligand-Target Pair