BDBM50271991 (2S,5R)-1-(2-{bicyclo[2.2.1]heptan-2-yl}ethyl)-2,5-dicyclohexyl-1H,2H,3H,5H,6H-imidazo[1,2-a]imidazolidin-7-ium::(2S,5S)-1-(2-{bicyclo[2.2.1]heptan-2-yl}ethyl)-2,5-dicyclohexyl-1H,2H,3H,5H,6H-imidazo[1,2-a]imidazolidin-7-ium

SMILES: C(CN1C(C[N+]2=C1NCC2C1CCCCC1)C1CCCCC1)C1CC2CCC1C2

InChI Key: InChIKey=XVHHJJWYEWXZAL-UHFFFAOYSA-O

Data: 4 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 4 hits for monomerid = 50271991   

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
Kappa-type opioid receptor (Cavia porcellus (domestic guinea pig))	BDBM50271991 ((2S,5R)-1-(2-{bicyclo[2.2.1]heptan-2-yl}ethyl)-2,5...) Show SMILES C(CN1C(C[N+]2=C1NCC2C1CCCCC1)C1CCCCC1)C1CC2CCC1C2 |c:5,THB:0:22:28:26.25| Show InChI InChI=1S/C26H43N3/c1-3-7-20(8-4-1)24-17-27-26-28(14-13-23-16-19-11-12-22(23)15-19)25(18-29(24)26)21-9-5-2-6-10-21/h19-25H,1-18H2/p+1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	560	n/a	n/a	n/a	n/a	n/a	n/a
Torrey Pines Institute for Molecular Studies Curated by ChEMBL					Assay Description Displacement of [3H]U69593 from kappa opioid receptor in guinea pig brain homogenate				Bioorg Med Chem 16: 5932-8 (2008) Article DOI: 10.1016/j.bmc.2008.04.061 BindingDB Entry DOI: 10.7270/Q2BG2PW7
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Cavia porcellus (domestic guinea pig))	BDBM50271991 ((2S,5R)-1-(2-{bicyclo[2.2.1]heptan-2-yl}ethyl)-2,5...) Show SMILES C(CN1C(C[N+]2=C1NCC2C1CCCCC1)C1CCCCC1)C1CC2CCC1C2 |c:5,THB:0:22:28:26.25| Show InChI InChI=1S/C26H43N3/c1-3-7-20(8-4-1)24-17-27-26-28(14-13-23-16-19-11-12-22(23)15-19)25(18-29(24)26)21-9-5-2-6-10-21/h19-25H,1-18H2/p+1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	524	n/a	n/a	n/a	n/a	n/a	n/a
Torrey Pines Institute for Molecular Studies Curated by ChEMBL					Assay Description Displacement of [3H]U69593 from kappa opioid receptor in guinea pig brain homogenate				Bioorg Med Chem 16: 5932-8 (2008) Article DOI: 10.1016/j.bmc.2008.04.061 BindingDB Entry DOI: 10.7270/Q2BG2PW7
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50271991 ((2S,5R)-1-(2-{bicyclo[2.2.1]heptan-2-yl}ethyl)-2,5...) Show SMILES C(CN1C(C[N+]2=C1NCC2C1CCCCC1)C1CCCCC1)C1CC2CCC1C2 |c:5,THB:0:22:28:26.25| Show InChI InChI=1S/C26H43N3/c1-3-7-20(8-4-1)24-17-27-26-28(14-13-23-16-19-11-12-22(23)15-19)25(18-29(24)26)21-9-5-2-6-10-21/h19-25H,1-18H2/p+1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PubMed	n/a	n/a	560	n/a	n/a	n/a	n/a	n/a	n/a
Torrey Pines Institute for Molecular Studies Curated by ChEMBL					Assay Description Inhibitory activity for kappa opioid receptor				J Med Chem 42: 3743-78 (1999) BindingDB Entry DOI: 10.7270/Q22Z167W
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50271991 ((2S,5R)-1-(2-{bicyclo[2.2.1]heptan-2-yl}ethyl)-2,5...) Show SMILES C(CN1C(C[N+]2=C1NCC2C1CCCCC1)C1CCCCC1)C1CC2CCC1C2 |c:5,THB:0:22:28:26.25| Show InChI InChI=1S/C26H43N3/c1-3-7-20(8-4-1)24-17-27-26-28(14-13-23-16-19-11-12-22(23)15-19)25(18-29(24)26)21-9-5-2-6-10-21/h19-25H,1-18H2/p+1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PubMed	n/a	n/a	524	n/a	n/a	n/a	n/a	n/a	n/a
Torrey Pines Institute for Molecular Studies Curated by ChEMBL					Assay Description Inhibitory activity for kappa opioid receptor				J Med Chem 42: 3743-78 (1999) BindingDB Entry DOI: 10.7270/Q22Z167W
					More data for this Ligand-Target Pair