BDBM50098466 CHEMBL175511::N,N-Diethyl-4-{[3-methyl-1-(3-phenyl-allyl)-piperidin-4-yl]-phenyl-amino}-benzamide

SMILES: CCN(CC)C(=O)c1ccc(cc1)N([C@@H]1CCN(C\C=C\c2ccccc2)C[C@@H]1C)c1ccccc1

InChI Key: InChIKey=JTOOPHYTASNWHN-UMFUWCKNSA-N

Data: 3 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 3 hits for monomerid = 50098466   

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
Opioid receptors; mu & delta (Rattus norvegicus (rat))	BDBM50098466 (CHEMBL175511 | N,N-Diethyl-4-{[3-methyl-1-(3-pheny...) Show SMILES CCN(CC)C(=O)c1ccc(cc1)N([C@@H]1CCN(C\C=C\c2ccccc2)C[C@@H]1C)c1ccccc1 Show InChI InChI=1S/C32H39N3O/c1-4-34(5-2)32(36)28-18-20-30(21-19-28)35(29-16-10-7-11-17-29)31-22-24-33(25-26(31)3)23-12-15-27-13-8-6-9-14-27/h6-21,26,31H,4-5,22-25H2,1-3H3/b15-12+/t26-,31+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	68	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Research Triangle Institute Curated by ChEMBL					Assay Description Affinity of [H]DADLE to the delta opioid receptor from rat brain				J Med Chem 44: 972-87 (2001) BindingDB Entry DOI: 10.7270/Q2V69K8G
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50098466 (CHEMBL175511 | N,N-Diethyl-4-{[3-methyl-1-(3-pheny...) Show SMILES CCN(CC)C(=O)c1ccc(cc1)N([C@@H]1CCN(C\C=C\c2ccccc2)C[C@@H]1C)c1ccccc1 Show InChI InChI=1S/C32H39N3O/c1-4-34(5-2)32(36)28-18-20-30(21-19-28)35(29-16-10-7-11-17-29)31-22-24-33(25-26(31)3)23-12-15-27-13-8-6-9-14-27/h6-21,26,31H,4-5,22-25H2,1-3H3/b15-12+/t26-,31+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	6.43E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Research Triangle Institute Curated by ChEMBL					Assay Description Affinity of [3H]DAMGO to the mu opioid receptor from rat brain				J Med Chem 44: 972-87 (2001) BindingDB Entry DOI: 10.7270/Q2V69K8G
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Rattus norvegicus (rat))	BDBM50098466 (CHEMBL175511 | N,N-Diethyl-4-{[3-methyl-1-(3-pheny...) Show SMILES CCN(CC)C(=O)c1ccc(cc1)N([C@@H]1CCN(C\C=C\c2ccccc2)C[C@@H]1C)c1ccccc1 Show InChI InChI=1S/C32H39N3O/c1-4-34(5-2)32(36)28-18-20-30(21-19-28)35(29-16-10-7-11-17-29)31-22-24-33(25-26(31)3)23-12-15-27-13-8-6-9-14-27/h6-21,26,31H,4-5,22-25H2,1-3H3/b15-12+/t26-,31+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.35E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Research Triangle Institute Curated by ChEMBL					Assay Description Affinity of [3H]U-69593 to opioid receptor kappa 1 from rat brain				J Med Chem 44: 972-87 (2001) BindingDB Entry DOI: 10.7270/Q2V69K8G
					More data for this Ligand-Target Pair