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Compile Data Set for Download or QSAR

Found 4 hits of ic50 for monomerid = 71598   
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))
BDBM71598
PNG
(KSC-1-180 | KUC104211N | cid_22553432)
Show SMILES CN1CCN(CCCNC(=O)Cn2c3ncccc3n3cccc3c2=O)CC1
Show InChI InChI=1S/C20H26N6O2/c1-23-11-13-24(14-12-23)9-4-8-21-18(27)15-26-19-16(5-2-7-22-19)25-10-3-6-17(25)20(26)28/h2-3,5-7,10H,4,8-9,11-15H2,1H3,(H,21,27)
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n/an/a>2.00E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Burnham Institute for Medical Research (BIMR, La Jolla, CA) Network: NIH...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q22F7KW2
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM71598
PNG
(KSC-1-180 | KUC104211N | cid_22553432)
Show SMILES CN1CCN(CCCNC(=O)Cn2c3ncccc3n3cccc3c2=O)CC1
Show InChI InChI=1S/C20H26N6O2/c1-23-11-13-24(14-12-23)9-4-8-21-18(27)15-26-19-16(5-2-7-22-19)25-10-3-6-17(25)20(26)28/h2-3,5-7,10H,4,8-9,11-15H2,1H3,(H,21,27)
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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 (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2G73C59
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM71598
PNG
(KSC-1-180 | KUC104211N | cid_22553432)
Show SMILES CN1CCN(CCCNC(=O)Cn2c3ncccc3n3cccc3c2=O)CC1
Show InChI InChI=1S/C20H26N6O2/c1-23-11-13-24(14-12-23)9-4-8-21-18(27)15-26-19-16(5-2-7-22-19)25-10-3-6-17(25)20(26)28/h2-3,5-7,10H,4,8-9,11-15H2,1H3,(H,21,27)
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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 (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q26Q1VQV
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM71598
PNG
(KSC-1-180 | KUC104211N | cid_22553432)
Show SMILES CN1CCN(CCCNC(=O)Cn2c3ncccc3n3cccc3c2=O)CC1
Show InChI InChI=1S/C20H26N6O2/c1-23-11-13-24(14-12-23)9-4-8-21-18(27)15-26-19-16(5-2-7-22-19)25-10-3-6-17(25)20(26)28/h2-3,5-7,10H,4,8-9,11-15H2,1H3,(H,21,27)
PDB

Reactome pathway
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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 (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q27P8WW4
More data for this
Ligand-Target Pair