BDBM50188204 4-[(2S,5S,8S,11S,14S,17S)-1-amino-8-benzyl-17-(ethylamino)-2,5,11,14-tetrakis[(4-hydroxyphenyl)methyl]-3,6,9,12,15-pentaazaoctadecan-18-yl]phenol::CHEMBL218875

SMILES: CCN[C@H](CN[C@H](CN[C@H](CN[C@H](CN[C@H](CN[C@H](CN)Cc1ccc(O)cc1)Cc1ccc(O)cc1)Cc1ccccc1)Cc1ccc(O)cc1)Cc1ccc(O)cc1)Cc1ccc(O)cc1

InChI Key: InChIKey=KDNOUEDJZZWCQZ-QXYUJABFSA-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 = 50188204   

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))	BDBM50188204 (4-[(2S,5S,8S,11S,14S,17S)-1-amino-8-benzyl-17-(eth...) Show SMILES CCN[C@H](CN[C@H](CN[C@H](CN[C@H](CN[C@H](CN[C@H](CN)Cc1ccc(O)cc1)Cc1ccc(O)cc1)Cc1ccccc1)Cc1ccc(O)cc1)Cc1ccc(O)cc1)Cc1ccc(O)cc1 Show InChI InChI=1S/C56H73N7O5/c1-2-58-47(30-42-10-20-53(65)21-11-42)35-60-50(32-44-14-24-55(67)25-15-44)38-63-51(33-45-16-26-56(68)27-17-45)39-61-48(29-40-6-4-3-5-7-40)37-62-49(31-43-12-22-54(66)23-13-43)36-59-46(34-57)28-41-8-18-52(64)19-9-41/h3-27,46-51,58-68H,2,28-39,57H2,1H3/t46-,47-,48-,49-,50-,51-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	261	n/a	n/a	n/a	n/a	n/a	n/a
Institute for Molecular Studies Curated by ChEMBL					Assay Description Displacement of [3H]DAMGO from mu opioid receptor in rat brain homogenate				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