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BDBM50312830 1-(4-chlorophenyl)-N'-(4-fluoropiperidin-1-ylsulfonyl)-N-methyl-5-phenyl-4,5-dihydro-1H-pyrazole-3-carboximidamide::CHEMBL1081832

SMILES: CNC(=NS(=O)(=O)N1CCC(F)CC1)C1=NN(C(C1)c1ccccc1)c1ccc(Cl)cc1

InChI Key: InChIKey=UNTFMKWQIPWJAC-UHFFFAOYSA-N

Data: 2 KI

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

Found 2 hits for monomerid = 50312830   
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
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50312830
PNG
(1-(4-chlorophenyl)-N'-(4-fluoropiperidin-1-ylsulfo...)
Show SMILES CNC(=NS(=O)(=O)N1CCC(F)CC1)C1=NN(C(C1)c1ccccc1)c1ccc(Cl)cc1 |w:3.3,t:15|
Show InChI InChI=1S/C22H25ClFN5O2S/c1-25-22(27-32(30,31)28-13-11-18(24)12-14-28)20-15-21(16-5-3-2-4-6-16)29(26-20)19-9-7-17(23)8-10-19/h2-10,18,21H,11-15H2,1H3,(H,25,27)
PDB

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PC cid
PC sid
UniChem

Similars

Article
PubMed
55n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human cannabinoid CB1 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 1752-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.049
BindingDB Entry DOI: 10.7270/Q2736RWV
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50312830
PNG
(1-(4-chlorophenyl)-N'-(4-fluoropiperidin-1-ylsulfo...)
Show SMILES CNC(=NS(=O)(=O)N1CCC(F)CC1)C1=NN(C(C1)c1ccccc1)c1ccc(Cl)cc1 |w:3.3,t:15|
Show InChI InChI=1S/C22H25ClFN5O2S/c1-25-22(27-32(30,31)28-13-11-18(24)12-14-28)20-15-21(16-5-3-2-4-6-16)29(26-20)19-9-7-17(23)8-10-19/h2-10,18,21H,11-15H2,1H3,(H,25,27)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human cannabinoid CB2 receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 1752-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.049
BindingDB Entry DOI: 10.7270/Q2736RWV
More data for this
Ligand-Target Pair