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Found 3 hits Enz. Inhib. hit(s) with Target = 'Kappa-type opioid receptor' and Ligand = 'BDBM65824'   
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
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM65824
PNG
(2-[5-(p-anisylthio)-4-(2-thenyl)-1,2,4-triazol-3-y...)
Show SMILES COc1ccc(CSc2nnc(-c3ccccn3)n2Cc2cccs2)cc1
Show InChI InChI=1S/C20H18N4OS2/c1-25-16-9-7-15(8-10-16)14-27-20-23-22-19(18-6-2-3-11-21-18)24(20)13-17-5-4-12-26-17/h2-12H,13-14H2,1H3
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PC cid
PC sid
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n/an/a>3.20E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics Source Affiliation: Sanford-Burnham Medical Research Institute Network: NIH Molecular Lib...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2X63KC5
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM65824
PNG
(2-[5-(p-anisylthio)-4-(2-thenyl)-1,2,4-triazol-3-y...)
Show SMILES COc1ccc(CSc2nnc(-c3ccccn3)n2Cc2cccs2)cc1
Show InChI InChI=1S/C20H18N4OS2/c1-25-16-9-7-15(8-10-16)14-27-20-23-22-19(18-6-2-3-11-21-18)24(20)13-17-5-4-12-26-17/h2-12H,13-14H2,1H3
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PC cid
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UniChem

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n/an/an/an/a 9.61E+3n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2D50KDG
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM65824
PNG
(2-[5-(p-anisylthio)-4-(2-thenyl)-1,2,4-triazol-3-y...)
Show SMILES COc1ccc(CSc2nnc(-c3ccccn3)n2Cc2cccs2)cc1
Show InChI InChI=1S/C20H18N4OS2/c1-25-16-9-7-15(8-10-16)14-27-20-23-22-19(18-6-2-3-11-21-18)24(20)13-17-5-4-12-26-17/h2-12H,13-14H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
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PC cid
PC sid
UniChem

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PCBioAssay
n/an/an/an/a 5.98E+3n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics Source Affiliation: Sanford-Burnham Medical Research Institute Network: NIH Molecular Lib...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2HX1B4W
More data for this
Ligand-Target Pair