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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 = 'BDBM50095746'   
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))		BDBM50095746
PNG
(3-{2-[2-({2-[2-Amino-3-(4-hydroxy-phenyl)-propiony...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1Cc2ccccc2C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](CC(O)=O)C(N)=O
Show InChI InChI=1S/C41H44N6O8/c42-31(19-27-15-17-30(48)18-16-27)41(55)47-24-29-14-8-7-13-28(29)22-35(47)40(54)46-34(21-26-11-5-2-6-12-26)39(53)45-33(20-25-9-3-1-4-10-25)38(52)44-32(37(43)51)23-36(49)50/h1-18,31-35,48H,19-24,42H2,(H2,43,51)(H,44,52)(H,45,53)(H,46,54)(H,49,50)/t31?,32-,33?,34?,35?/m1/s1
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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