BDBM116199 US8637502, 9

SMILES: CC(C)C1CCC(CC1)N1CCC(CC1)n1c2ccccc2[nH]c(=O)c1=O

InChI Key: InChIKey=GBRKRVVJROXVMX-UHFFFAOYSA-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 = 116199   

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
Nociceptin receptor (Homo sapiens (Human))	BDBM116199 (US8637502, 9) Show SMILES CC(C)C1CCC(CC1)N1CCC(CC1)n1c2ccccc2[nH]c(=O)c1=O |(2,-7.31,;.67,-6.54,;-.67,-7.31,;.67,-5,;-.67,-4.23,;-.67,-2.69,;.67,-1.93,;2,-2.69,;2,-4.23,;.67,-.38,;-.67,.38,;-.67,1.93,;.67,2.69,;2,1.93,;2,.38,;.67,4.23,;-.67,5,;-2,4.23,;-3.33,5,;-3.33,6.54,;-2,7.31,;-.67,6.54,;.67,7.31,;2,6.54,;3.33,7.31,;2,5,;3.33,4.23,)| Show InChI InChI=1S/C22H31N3O2/c1-15(2)16-7-9-17(10-8-16)24-13-11-18(12-14-24)25-20-6-4-3-5-19(20)23-21(26)22(25)27/h3-6,15-18H,7-14H2,1-2H3,(H,23,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	22.8	-9.68	n/a	n/a	n/a	n/a	n/a	7.4	4
Purde Pharma L.P.; Shionogi & Co., Ltd. US Patent					Assay Description ORL-1 Receptor Binding Assay Procedures: Membranes from recombinant HEK-293 cells expressing the human opioid receptor-like receptor (ORL-1) (Recepto...				US Patent US8637502 (2014) BindingDB Entry DOI: 10.7270/Q2P55M54
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM116199 (US8637502, 9) Show SMILES CC(C)C1CCC(CC1)N1CCC(CC1)n1c2ccccc2[nH]c(=O)c1=O |(2,-7.31,;.67,-6.54,;-.67,-7.31,;.67,-5,;-.67,-4.23,;-.67,-2.69,;.67,-1.93,;2,-2.69,;2,-4.23,;.67,-.38,;-.67,.38,;-.67,1.93,;.67,2.69,;2,1.93,;2,.38,;.67,4.23,;-.67,5,;-2,4.23,;-3.33,5,;-3.33,6.54,;-2,7.31,;-.67,6.54,;.67,7.31,;2,6.54,;3.33,7.31,;2,5,;3.33,4.23,)| Show InChI InChI=1S/C22H31N3O2/c1-15(2)16-7-9-17(10-8-16)24-13-11-18(12-14-24)25-20-6-4-3-5-19(20)23-21(26)22(25)27/h3-6,15-18H,7-14H2,1-2H3,(H,23,26)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	825	-8.29	n/a	n/a	n/a	n/a	n/a	7.4	25
Purde Pharma L.P.; Shionogi & Co., Ltd. US Patent					Assay Description μ-Opioid Receptor Binding Assay Procedures: Radioligand dose-displacement binding assays for μ-opioid receptors used 0.2 nM[3H]-diprenorphi...				US Patent US8637502 (2014) BindingDB Entry DOI: 10.7270/Q2P55M54
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM116199 (US8637502, 9) Show SMILES CC(C)C1CCC(CC1)N1CCC(CC1)n1c2ccccc2[nH]c(=O)c1=O |(2,-7.31,;.67,-6.54,;-.67,-7.31,;.67,-5,;-.67,-4.23,;-.67,-2.69,;.67,-1.93,;2,-2.69,;2,-4.23,;.67,-.38,;-.67,.38,;-.67,1.93,;.67,2.69,;2,1.93,;2,.38,;.67,4.23,;-.67,5,;-2,4.23,;-3.33,5,;-3.33,6.54,;-2,7.31,;-.67,6.54,;.67,7.31,;2,6.54,;3.33,7.31,;2,5,;3.33,4.23,)| Show InChI InChI=1S/C22H31N3O2/c1-15(2)16-7-9-17(10-8-16)24-13-11-18(12-14-24)25-20-6-4-3-5-19(20)23-21(26)22(25)27/h3-6,15-18H,7-14H2,1-2H3,(H,23,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	880	-7.67	n/a	n/a	n/a	n/a	n/a	7.4	4
Purde Pharma L.P.; Shionogi & Co., Ltd. US Patent					Assay Description κ-Opioid Receptor Binding Assay Procedures: Membranes from recombinant HEK-293 cells expressing the human kappa opioid receptor (kappa) (cloned ...				US Patent US8637502 (2014) BindingDB Entry DOI: 10.7270/Q2P55M54
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM116199 (US8637502, 9) Show SMILES CC(C)C1CCC(CC1)N1CCC(CC1)n1c2ccccc2[nH]c(=O)c1=O |(2,-7.31,;.67,-6.54,;-.67,-7.31,;.67,-5,;-.67,-4.23,;-.67,-2.69,;.67,-1.93,;2,-2.69,;2,-4.23,;.67,-.38,;-.67,.38,;-.67,1.93,;.67,2.69,;2,1.93,;2,.38,;.67,4.23,;-.67,5,;-2,4.23,;-3.33,5,;-3.33,6.54,;-2,7.31,;-.67,6.54,;.67,7.31,;2,6.54,;3.33,7.31,;2,5,;3.33,4.23,)| Show InChI InChI=1S/C22H31N3O2/c1-15(2)16-7-9-17(10-8-16)24-13-11-18(12-14-24)25-20-6-4-3-5-19(20)23-21(26)22(25)27/h3-6,15-18H,7-14H2,1-2H3,(H,23,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	9.60E+3	-6.84	n/a	n/a	n/a	n/a	n/a	7.4	25
Purde Pharma L.P.; Shionogi & Co., Ltd. US Patent					Assay Description δ-Receptor Binding Assay Procedures: Radioligand dose-displacement assays used 0.2 nM [3H]-Naltrindole (NEN; 33.0 Ci/mmole) with 10-20 μg m...				US Patent US8637502 (2014) BindingDB Entry DOI: 10.7270/Q2P55M54
					More data for this Ligand-Target Pair