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SMILES: [H]C12CCC([H])(C=C(C1)N(CCc1ccccc1)C(=O)c1cc(C)cc(C)c1)N2C

InChI Key: InChIKey=KVPMZTMVCZWXSC-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 83363   
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))		BDBM83363
PNG
(3,5-dimethyl-N-(8-methyl-8-azabicyclo[3.2.1]oct-3-...)
Show SMILES [H]C12CCC([H])(C=C(C1)N(CCc1ccccc1)C(=O)c1cc(C)cc(C)c1)N2C |c:6|
Show InChI InChI=1S/C25H30N2O/c1-18-13-19(2)15-21(14-18)25(28)27(12-11-20-7-5-4-6-8-20)24-16-22-9-10-23(17-24)26(22)3/h4-8,13-16,22-23H,9-12,17H2,1-3H3
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Similars
PCBioAssay
n/an/an/an/a>9.25E+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