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SMILES [H][C@]12C[C@@]1([C@@H](O)[C@@H](O)[C@@H]2n1ccc2c(NCCc3ccccc3)nc(nc12)C#Cc1ccccc1)C(=O)OCC

InChI Key

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 10 hits for monomerid = 50603613   

TargetKappa-type opioid receptor(Homo sapiens (Human))TBA
LigandPNGBDBM50603613(CHEMBL5169644)copy SMILES
Affinity DataKi:  207nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails
TargetKappa-type opioid receptor(Homo sapiens (Human))TBA
LigandPNGBDBM50603613(CHEMBL5169644)copy SMILES
Affinity DataKi:  210nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2PV6QGPPubMed
TargetAdenosine receptor A3(Homo sapiens (Human))TBA
LigandPNGBDBM50603613(CHEMBL5169644)copy SMILES
Affinity DataKi:  483nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2PV6QGPPubMed
TargetAdenosine receptor A3(Homo sapiens (Human))TBA
LigandPNGBDBM50603613(CHEMBL5169644)copy SMILES
Affinity DataKi:  483nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails
TargetDelta-type opioid receptor(Homo sapiens (Human))TBA
LigandPNGBDBM50603613(CHEMBL5169644)copy SMILES
Affinity DataKi:  627nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails
TargetAdenosine receptor A3(Mus musculus)TBA
LigandPNGBDBM50603613(CHEMBL5169644)copy SMILES
Affinity DataKi: >1.00E+4nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2PV6QGPPubMed
TargetMu-type opioid receptor(Homo sapiens (Human))TBA
LigandPNGBDBM50603613(CHEMBL5169644)copy SMILES
Affinity DataKi: >1.00E+4nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails
TargetAdenosine receptor A3(Mus musculus)TBA
LigandPNGBDBM50603613(CHEMBL5169644)copy SMILES
Affinity DataKi: >1.00E+4nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails