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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 = 'BDBM50290890'   
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)		BDBM50290890
PNG
((S)-2-[2-tert-Butoxycarbonylamino-3-(4-hydroxy-2,6...)
Show SMILES CC(C(NC(=O)OC(C)(C)C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)OCc1ccccc1)c1c(C)cc(O)cc1C
Show InChI InChI=1S/C34H40N2O6/c1-21-16-27(37)17-22(2)29(21)23(3)30(35-33(40)42-34(4,5)6)31(38)36-19-26-15-11-10-14-25(26)18-28(36)32(39)41-20-24-12-8-7-9-13-24/h7-17,23,28,30,37H,18-20H2,1-6H3,(H,35,40)/t23?,28-,30?/m0/s1
PDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
n/an/a 8.40E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
The compound was evaluated for the binding affinity towards mu-opioid receptor by displacement of [3H]-DAMGO radioligand from guinea pig ileum

Bioorg Med Chem Lett 7: 3049-3052 (1997)


Article DOI: 10.1016/S0960-894X(97)10145-7
BindingDB Entry DOI: 10.7270/Q2H13211
More data for this
Ligand-Target Pair