BDBM50299395 4-((1-benzylpiperidin-4-yl)(3-((dimethylamino)methyl)phenyl)amino)-N,N-diethylbenzamide::CHEMBL577359

SMILES: CCN(CC)C(=O)c1ccc(cc1)N(C1CCN(Cc2ccccc2)CC1)c1cccc(CN(C)C)c1

InChI Key: InChIKey=IAHYHCFVFBNLJM-UHFFFAOYSA-N

Data: 3 KI  1 EC50

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 = 50299395   

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))	BDBM50299395 (4-((1-benzylpiperidin-4-yl)(3-((dimethylamino)meth...) Show SMILES CCN(CC)C(=O)c1ccc(cc1)N(C1CCN(Cc2ccccc2)CC1)c1cccc(CN(C)C)c1 Show InChI InChI=1S/C32H42N4O/c1-5-35(6-2)32(37)28-15-17-29(18-16-28)36(31-14-10-13-27(23-31)24-33(3)4)30-19-21-34(22-20-30)25-26-11-8-7-9-12-26/h7-18,23,30H,5-6,19-22,24-25H2,1-4H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	34	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca R&D Montr£al Curated by ChEMBL					Assay Description Displacement of [125I]-[D-Ala2]deltorphin 2 from human cloned delta opioid receptor				Bioorg Med Chem Lett 19: 5999-6003 (2009) Article DOI: 10.1016/j.bmcl.2009.09.068 BindingDB Entry DOI: 10.7270/Q2XP7512
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50299395 (4-((1-benzylpiperidin-4-yl)(3-((dimethylamino)meth...) Show SMILES CCN(CC)C(=O)c1ccc(cc1)N(C1CCN(Cc2ccccc2)CC1)c1cccc(CN(C)C)c1 Show InChI InChI=1S/C32H42N4O/c1-5-35(6-2)32(37)28-15-17-29(18-16-28)36(31-14-10-13-27(23-31)24-33(3)4)30-19-21-34(22-20-30)25-26-11-8-7-9-12-26/h7-18,23,30H,5-6,19-22,24-25H2,1-4H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.75E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca R&D Montr£al Curated by ChEMBL					Assay Description Displacement of [125I]D-pro10-dynorphin from human cloned kappa opioid receptor				Bioorg Med Chem Lett 19: 5999-6003 (2009) Article DOI: 10.1016/j.bmcl.2009.09.068 BindingDB Entry DOI: 10.7270/Q2XP7512
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50299395 (4-((1-benzylpiperidin-4-yl)(3-((dimethylamino)meth...) Show SMILES CCN(CC)C(=O)c1ccc(cc1)N(C1CCN(Cc2ccccc2)CC1)c1cccc(CN(C)C)c1 Show InChI InChI=1S/C32H42N4O/c1-5-35(6-2)32(37)28-15-17-29(18-16-28)36(31-14-10-13-27(23-31)24-33(3)4)30-19-21-34(22-20-30)25-26-11-8-7-9-12-26/h7-18,23,30H,5-6,19-22,24-25H2,1-4H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.16E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca R&D Montr£al Curated by ChEMBL					Assay Description Displacement of [125I]FK33824 from human cloned mu opioid receptor				Bioorg Med Chem Lett 19: 5999-6003 (2009) Article DOI: 10.1016/j.bmcl.2009.09.068 BindingDB Entry DOI: 10.7270/Q2XP7512
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50299395 (4-((1-benzylpiperidin-4-yl)(3-((dimethylamino)meth...) Show SMILES CCN(CC)C(=O)c1ccc(cc1)N(C1CCN(Cc2ccccc2)CC1)c1cccc(CN(C)C)c1 Show InChI InChI=1S/C32H42N4O/c1-5-35(6-2)32(37)28-15-17-29(18-16-28)36(31-14-10-13-27(23-31)24-33(3)4)30-19-21-34(22-20-30)25-26-11-8-7-9-12-26/h7-18,23,30H,5-6,19-22,24-25H2,1-4H3	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	n/a	n/a	277	n/a	n/a	n/a	n/a
AstraZeneca R&D Montr£al Curated by ChEMBL					Assay Description Agonist activity at human delta opioid receptor by GTP[gamma]35S binding assay				Bioorg Med Chem Lett 19: 5999-6003 (2009) Article DOI: 10.1016/j.bmcl.2009.09.068 BindingDB Entry DOI: 10.7270/Q2XP7512
					More data for this Ligand-Target Pair