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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Mu-type opioid receptor' and Ligand = 'BDBM50188210'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Mu-type opioid receptor


(GUINEA PIG)		BDBM50188210
PNG
(4-[(2S)-2-amino-3-{[(2S)-1-(4-hydroxyphenyl)-3-{me...)
Show SMILES CNC[C@@H]1CCCN1C[C@H](Cc1ccccc1)N(C)C[C@H](Cc1ccc(O)cc1)N(C)C[C@@H](N)Cc1ccc(O)cc1
Show InChI InChI=1S/C35H51N5O2/c1-37-23-31-10-7-19-40(31)26-33(21-27-8-5-4-6-9-27)39(3)25-32(22-29-13-17-35(42)18-14-29)38(2)24-30(36)20-28-11-15-34(41)16-12-28/h4-6,8-9,11-18,30-33,37,41-42H,7,10,19-26,36H2,1-3H3/t30-,31-,32-,33-/m0/s1
PDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 13n/an/an/an/an/an/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