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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 = 'BDBM50095756'   
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))
BDBM50095756
PNG
(3-[2-({2-[2-Amino-3-(4-hydroxy-phenyl)-propionyl]-...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1Cc2ccccc2C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(O)=O)C(N)=O |r|
Show InChI InChI=1S/C32H35N5O7/c33-24(14-20-10-12-23(38)13-11-20)32(44)37-18-22-9-5-4-8-21(22)16-27(37)31(43)36-26(15-19-6-2-1-3-7-19)30(42)35-25(29(34)41)17-28(39)40/h1-13,24-27,38H,14-18,33H2,(H2,34,41)(H,35,42)(H,36,43)(H,39,40)/t24?,25-,26?,27?/m1/s1
PDB

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PC cid
PC sid
UniChem

Similars

PubMed
>4.00E+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