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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 = 'BDBM50095743'   
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


(Homo sapiens (Human))		BDBM50095743
PNG
(6-Amino-2-[2-({2-[2-amino-3-(4-hydroxy-phenyl)-pro...)
Show SMILES CC(=O)C(N)CCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](N)Cc1ccc(O)cc1)C(O)=O |r|
Show InChI InChI=1S/C36H43N5O7/c1-22(42)28(37)12-7-13-30(36(47)48)39-33(44)31(19-23-8-3-2-4-9-23)40-34(45)32-20-25-10-5-6-11-26(25)21-41(32)35(46)29(38)18-24-14-16-27(43)17-15-24/h2-6,8-11,14-17,28-32,43H,7,12-13,18-21,37-38H2,1H3,(H,39,44)(H,40,45)(H,47,48)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
>4.50E+3n/an/an/an/an/an/an/an/a



University of Maryland

Curated by ChEMBL


Assay Description
Affinity towards human Opioid receptor mu 1 on CHO cell membranes using [3H]DAMGO displacement.

J Med Chem 43: 5050-4 (2001)


BindingDB Entry DOI: 10.7270/Q20P0Z8P
More data for this
Ligand-Target Pair