null

SMILES: CCN(CC)C(=O)c1ccc(cc1)[C@@H](N1C[C@@H](C)N(Cc2ccc3OCOc3c2)C[C@@H]1C)c1ccccc1

InChI Key: InChIKey=SZFYNVCLGPAKLJ-OXYPMYLPSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50077089   

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
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50077089 (4-[(S)-((2S,5R)-4-Benzo[1,3]dioxol-5-ylmethyl-2,5-...) Show SMILES CCN(CC)C(=O)c1ccc(cc1)[C@@H](N1C[C@@H](C)N(Cc2ccc3OCOc3c2)C[C@@H]1C)c1ccccc1 Show InChI InChI=1S/C32H39N3O3/c1-5-33(6-2)32(36)28-15-13-27(14-16-28)31(26-10-8-7-9-11-26)35-20-23(3)34(19-24(35)4)21-25-12-17-29-30(18-25)38-22-37-29/h7-18,23-24,31H,5-6,19-22H2,1-4H3/t23-,24+,31+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	702	n/a	n/a	n/a	n/a	n/a	n/a
Organon Laboratories Ltd. Curated by ChEMBL					Assay Description Binding affinity towards mu opioid receptor using [3H]- -DAMGO (1.5 nM) as radioligand in rat brain membranes				Bioorg Med Chem Lett 9: 1329-34 (1999) BindingDB Entry DOI: 10.7270/Q2V40TCM
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50077089 (4-[(S)-((2S,5R)-4-Benzo[1,3]dioxol-5-ylmethyl-2,5-...) Show SMILES CCN(CC)C(=O)c1ccc(cc1)[C@@H](N1C[C@@H](C)N(Cc2ccc3OCOc3c2)C[C@@H]1C)c1ccccc1 Show InChI InChI=1S/C32H39N3O3/c1-5-33(6-2)32(36)28-15-13-27(14-16-28)31(26-10-8-7-9-11-26)35-20-23(3)34(19-24(35)4)21-25-12-17-29-30(18-25)38-22-37-29/h7-18,23-24,31H,5-6,19-22H2,1-4H3/t23-,24+,31+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	0.540	n/a	n/a	n/a	n/a	n/a	n/a
Organon Laboratories Ltd. Curated by ChEMBL					Assay Description Inhibition of binding of [3H]- -naltrindole (0.15 nM) to membranes from CHO cells expressing Opioid receptor delta 1				Bioorg Med Chem Lett 9: 1329-34 (1999) BindingDB Entry DOI: 10.7270/Q2V40TCM
					More data for this Ligand-Target Pair