BDBM116196 US8637502, 6

SMILES: O=c1[nH]c2ccccc2n(C2CCN(CC2)C2CCCCCCC2)c1=O

InChI Key: InChIKey=NMRCIXCOZCASLP-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 = 116196   

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))	BDBM116196 (US8637502, 6) Show SMILES O=c1[nH]c2ccccc2n(C2CCN(CC2)C2CCCCCCC2)c1=O Show InChI InChI=1S/C21H29N3O2/c25-20-21(26)24(19-11-7-6-10-18(19)22-20)17-12-14-23(15-13-17)16-8-4-2-1-3-5-9-16/h6-7,10-11,16-17H,1-5,8-9,12-15H2,(H,22,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	65	-9.11	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
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM116196 (US8637502, 6) Show SMILES O=c1[nH]c2ccccc2n(C2CCN(CC2)C2CCCCCCC2)c1=O Show InChI InChI=1S/C21H29N3O2/c25-20-21(26)24(19-11-7-6-10-18(19)22-20)17-12-14-23(15-13-17)16-8-4-2-1-3-5-9-16/h6-7,10-11,16-17H,1-5,8-9,12-15H2,(H,22,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	167	-8.59	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
Mu-type opioid receptor (Homo sapiens (Human))	BDBM116196 (US8637502, 6) Show SMILES O=c1[nH]c2ccccc2n(C2CCN(CC2)C2CCCCCCC2)c1=O Show InChI InChI=1S/C21H29N3O2/c25-20-21(26)24(19-11-7-6-10-18(19)22-20)17-12-14-23(15-13-17)16-8-4-2-1-3-5-9-16/h6-7,10-11,16-17H,1-5,8-9,12-15H2,(H,22,25)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2.20E+3	-7.71	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
Delta-type opioid receptor (Homo sapiens (Human))	BDBM116196 (US8637502, 6) Show SMILES O=c1[nH]c2ccccc2n(C2CCN(CC2)C2CCCCCCC2)c1=O Show InChI InChI=1S/C21H29N3O2/c25-20-21(26)24(19-11-7-6-10-18(19)22-20)17-12-14-23(15-13-17)16-8-4-2-1-3-5-9-16/h6-7,10-11,16-17H,1-5,8-9,12-15H2,(H,22,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	2.90E+3	-7.55	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