BDBM50088748 CHEMBL13454::N-Butyl-4-[((1R,3S,5S)-8-methyl-8-aza-bicyclo[3.2.1]oct-3-yl)-phenyl-amino]-N-propyl-benzamide

SMILES: CCCCN(CCC)C(=O)c1ccc(cc1)N([C@H]1C[C@@H]2CC[C@H](C1)N2C)c1ccccc1

InChI Key: InChIKey=DTPRRMMBCILGCY-LGKQTMLJSA-N

Data: 2 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 2 hits for monomerid = 50088748   

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))	BDBM50088748 (CHEMBL13454 | N-Butyl-4-[((1R,3S,5S)-8-methyl-8-az...) Show SMILES CCCCN(CCC)C(=O)c1ccc(cc1)N([C@H]1C[C@@H]2CC[C@H](C1)N2C)c1ccccc1 |THB:25:24:17.23.18:21.20| Show InChI InChI=1S/C28H39N3O/c1-4-6-19-30(18-5-2)28(32)22-12-14-24(15-13-22)31(23-10-8-7-9-11-23)27-20-25-16-17-26(21-27)29(25)3/h7-15,25-27H,4-6,16-21H2,1-3H3/t25-,26+,27-	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
R. W. Johnson Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibition of [3H]-DPDPE radioligand binding to rat opioid receptor delta 1 site from rat brain membranes				Bioorg Med Chem Lett 10: 1109-11 (2000) BindingDB Entry DOI: 10.7270/Q2X0668B
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50088748 (CHEMBL13454 | N-Butyl-4-[((1R,3S,5S)-8-methyl-8-az...) Show SMILES CCCCN(CCC)C(=O)c1ccc(cc1)N([C@H]1C[C@@H]2CC[C@H](C1)N2C)c1ccccc1 |THB:25:24:17.23.18:21.20| Show InChI InChI=1S/C28H39N3O/c1-4-6-19-30(18-5-2)28(32)22-12-14-24(15-13-22)31(23-10-8-7-9-11-23)27-20-25-16-17-26(21-27)29(25)3/h7-15,25-27H,4-6,16-21H2,1-3H3/t25-,26+,27-	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.73E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
R. W. Johnson Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Binding affinity of the compound was determined by inhibition of [3H]-DAMGO binding to Opioid receptor mu 1 from rat brain membranes				Bioorg Med Chem Lett 10: 1109-11 (2000) BindingDB Entry DOI: 10.7270/Q2X0668B
					More data for this Ligand-Target Pair