null

SMILES: COC(=O)CN1C(=O)C2(CCN(CC3CCCCCCC3)CC2)c2ccccc12

InChI Key: InChIKey=HFUCMBMATFVNGH-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50173254   

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
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50173254 (CHEMBL434944 | methyl 2-[1'-cyclooctylmethyl-2-oxo...) Show SMILES COC(=O)CN1C(=O)C2(CCN(CC3CCCCCCC3)CC2)c2ccccc12 Show InChI InChI=1S/C24H34N2O3/c1-29-22(27)18-26-21-12-8-7-11-20(21)24(23(26)28)13-15-25(16-14-24)17-19-9-5-3-2-4-6-10-19/h7-8,11-12,19H,2-6,9-10,13-18H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Johnson & Johnson Pharmaceutical Research and Development Curated by ChEMBL					Assay Description Binding affinity against human opioid receptor delta 1 expressed in HEK293 cells using [3H]DDPDE radioligand				Bioorg Med Chem Lett 15: 5022-6 (2005) Article DOI: 10.1016/j.bmcl.2005.08.009 BindingDB Entry DOI: 10.7270/Q2RF5TKC
					More data for this Ligand-Target Pair
Nociceptin receptor (Homo sapiens (Human))	BDBM50173254 (CHEMBL434944 | methyl 2-[1'-cyclooctylmethyl-2-oxo...) Show SMILES COC(=O)CN1C(=O)C2(CCN(CC3CCCCCCC3)CC2)c2ccccc12 Show InChI InChI=1S/C24H34N2O3/c1-29-22(27)18-26-21-12-8-7-11-20(21)24(23(26)28)13-15-25(16-14-24)17-19-9-5-3-2-4-6-10-19/h7-8,11-12,19H,2-6,9-10,13-18H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
Johnson & Johnson Pharmaceutical Research and Development Curated by ChEMBL					Assay Description Binding affinity determined by the ability to compete with [125I]-Tyr14- nociceptin from binding to human opiate receptor-like 1 expressed in HEK293 ...				Bioorg Med Chem Lett 15: 5022-6 (2005) Article DOI: 10.1016/j.bmcl.2005.08.009 BindingDB Entry DOI: 10.7270/Q2RF5TKC
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50173254 (CHEMBL434944 | methyl 2-[1'-cyclooctylmethyl-2-oxo...) Show SMILES COC(=O)CN1C(=O)C2(CCN(CC3CCCCCCC3)CC2)c2ccccc12 Show InChI InChI=1S/C24H34N2O3/c1-29-22(27)18-26-21-12-8-7-11-20(21)24(23(26)28)13-15-25(16-14-24)17-19-9-5-3-2-4-6-10-19/h7-8,11-12,19H,2-6,9-10,13-18H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	640	n/a	n/a	n/a	n/a	n/a	n/a
Johnson & Johnson Pharmaceutical Research and Development Curated by ChEMBL					Assay Description Binding affinity against human opioid receptor kappa 1 expressed in HEK293 cells using 3H-U69,593 radioligand				Bioorg Med Chem Lett 15: 5022-6 (2005) Article DOI: 10.1016/j.bmcl.2005.08.009 BindingDB Entry DOI: 10.7270/Q2RF5TKC
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50173254 (CHEMBL434944 | methyl 2-[1'-cyclooctylmethyl-2-oxo...) Show SMILES COC(=O)CN1C(=O)C2(CCN(CC3CCCCCCC3)CC2)c2ccccc12 Show InChI InChI=1S/C24H34N2O3/c1-29-22(27)18-26-21-12-8-7-11-20(21)24(23(26)28)13-15-25(16-14-24)17-19-9-5-3-2-4-6-10-19/h7-8,11-12,19H,2-6,9-10,13-18H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.55E+3	n/a	n/a	n/a	n/a	n/a	n/a
Johnson & Johnson Pharmaceutical Research and Development Curated by ChEMBL					Assay Description Binding affinity against human opioid receptor mu 1 expressed in HEK293 cells using [3H]DAMGO radioligand				Bioorg Med Chem Lett 15: 5022-6 (2005) Article DOI: 10.1016/j.bmcl.2005.08.009 BindingDB Entry DOI: 10.7270/Q2RF5TKC
					More data for this Ligand-Target Pair