BDBM50188208 4-[(2S)-2-amino-3-{[(2S)-1-(4-hydroxyphenyl)-3-[(naphthalen-2-ylmethyl)[(2S)-1-[(2S)-2-{[(naphthalen-2-ylmethyl)amino]methyl}pyrrolidin-1-yl]-3-phenylpropan-2-yl]amino]propan-2-yl](naphthalen-2-ylmethyl)amino}propyl]phenol::CHEMBL269502

SMILES: N[C@H](CN(Cc1ccc2ccccc2c1)[C@H](CN(Cc1ccc2ccccc2c1)[C@H](CN1CCC[C@H]1CNCc1ccc2ccccc2c1)Cc1ccccc1)Cc1ccc(O)cc1)Cc1ccc(O)cc1

InChI Key: InChIKey=GMFYBFACGRCIKD-RLANMGNTSA-N

Data: 1 IC50

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 1 hit for monomerid = 50188208   

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 (GUINEA PIG)	BDBM50188208 (4-[(2S)-2-amino-3-{[(2S)-1-(4-hydroxyphenyl)-3-[(n...) Show SMILES N[C@H](CN(Cc1ccc2ccccc2c1)[C@H](CN(Cc1ccc2ccccc2c1)[C@H](CN1CCC[C@H]1CNCc1ccc2ccccc2c1)Cc1ccccc1)Cc1ccc(O)cc1)Cc1ccc(O)cc1 Show InChI InChI=1S/C65H69N5O2/c66-60(38-49-23-30-64(71)31-24-49)45-69(43-52-21-28-55-14-5-8-17-58(55)36-52)63(40-50-25-32-65(72)33-26-50)47-70(44-53-22-29-56-15-6-9-18-59(56)37-53)62(39-48-11-2-1-3-12-48)46-68-34-10-19-61(68)42-67-41-51-20-27-54-13-4-7-16-57(54)35-51/h1-9,11-18,20-33,35-37,60-63,67,71-72H,10,19,34,38-47,66H2/t60-,61-,62-,63-/m0/s1	UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.86E+4	n/a	n/a	n/a	n/a	n/a	n/a
Institute for Molecular Studies Curated by ChEMBL					Assay Description Antagonist activity against mu opioid receptor in guinea-pig ileum assay				Bioorg Med Chem Lett 16: 4331-8 (2006) Article DOI: 10.1016/j.bmcl.2006.05.053 BindingDB Entry DOI: 10.7270/Q2028R47
					More data for this Ligand-Target Pair