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SMILES: COc1ccc(cc1OC)-c1nc(CN2CCC(CC2)C(=O)NC2CCCc3ccccc23)c(C)o1

InChI Key: InChIKey=MWTSUKHWPXHRNU-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 83293   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Delta-type opioid receptor


(Homo sapiens (Human))		BDBM83293
PNG
(1-[[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-...)
Show SMILES COc1ccc(cc1OC)-c1nc(CN2CCC(CC2)C(=O)NC2CCCc3ccccc23)c(C)o1
Show InChI InChI=1S/C29H35N3O4/c1-19-25(31-29(36-19)22-11-12-26(34-2)27(17-22)35-3)18-32-15-13-21(14-16-32)28(33)30-24-10-6-8-20-7-4-5-9-23(20)24/h4-5,7,9,11-12,17,21,24H,6,8,10,13-16,18H2,1-3H3,(H,30,33)
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Similars
PCBioAssay
n/an/an/an/a>9.24E+4n/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...

PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q22V2DN3
More data for this
Ligand-Target Pair