null

SMILES OC(=O)C(F)(F)F.OC(=O)C(F)(F)F.N\C(NCCCc1cnc(N)s1)=N/C(=O)NCc1ccccc1

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 17 hits for monomerid = 50601568   

TargetHistamine H2 receptor(Homo sapiens (Human))TBA
LigandPNGBDBM50601568(CHEMBL5178472)copy SMILES
Affinity DataKi:  27nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2MP57CTPubMed
TargetD(3) dopamine receptor(Homo sapiens)TBA
LigandPNGBDBM50601568(CHEMBL5178472)copy SMILES
Affinity DataKi:  74nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2MP57CTPubMed
TargetD(2) dopamine receptor(Homo sapiens (Human))TBA
LigandPNGBDBM50601568(CHEMBL5178472)copy SMILES
Affinity DataKi:  4.57E+3nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2MP57CTPubMed
TargetHistamine H1 receptor(Homo sapiens (Human))TBA
LigandPNGBDBM50601568(CHEMBL5178472)copy SMILES
Affinity DataKi:  5.62E+3nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2MP57CTPubMed
TargetHistamine H4 receptor(Homo sapiens (Human))TBA
LigandPNGBDBM50601568(CHEMBL5178472)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/Q2MP57CTPubMed
TargetHistamine H3 receptor(Homo sapiens (Human))TBA
LigandPNGBDBM50601568(CHEMBL5178472)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/Q2MP57CTPubMed
TargetHistamine H2 receptor(Homo sapiens (Human))TBA
LigandPNGBDBM50601568(CHEMBL5178472)copy SMILES
Affinity DataEC50:  49nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2MP57CTPubMed
TargetHistamine H2 receptor(Homo sapiens (Human))TBA
LigandPNGBDBM50601568(CHEMBL5178472)copy SMILES
Affinity DataEC50:  4.90nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2MP57CTPubMed
TargetD(2) dopamine receptor(Homo sapiens (Human))TBA
LigandPNGBDBM50601568(CHEMBL5178472)copy SMILES
Affinity DataEC50:  3.39E+3nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2MP57CTPubMed
TargetD(3) dopamine receptor(Homo sapiens)TBA
LigandPNGBDBM50601568(CHEMBL5178472)copy SMILES
Affinity DataEC50:  68nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2MP57CTPubMed
TargetD(3) dopamine receptor(Homo sapiens)TBA
LigandPNGBDBM50601568(CHEMBL5178472)copy SMILES
Affinity DataKd:  0.0258nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2MP57CTPubMed
TargetD(2) dopamine receptor(Homo sapiens (Human))TBA
LigandPNGBDBM50601568(CHEMBL5178472)copy SMILES
Affinity DataKd:  0.0149nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2MP57CTPubMed
TargetD(2) dopamine receptor(Homo sapiens (Human))TBA
LigandPNGBDBM50601568(CHEMBL5178472)copy SMILES
Affinity DataKd:  0.0149nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2MP57CTPubMed
TargetHistamine H4 receptor(Homo sapiens (Human))TBA
LigandPNGBDBM50601568(CHEMBL5178472)copy SMILES
Affinity DataKd:  16nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2MP57CTPubMed
TargetHistamine H3 receptor(Homo sapiens (Human))TBA
LigandPNGBDBM50601568(CHEMBL5178472)copy SMILES
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2MP57CTPubMed
TargetHistamine H1 receptor(Homo sapiens (Human))TBA
LigandPNGBDBM50601568(CHEMBL5178472)copy SMILES
Affinity DataKd:  4.5nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2MP57CTPubMed
TargetHistamine H2 receptor(Homo sapiens (Human))TBA
LigandPNGBDBM50601568(CHEMBL5178472)copy SMILES
Affinity DataKd:  12nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2MP57CTPubMed