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BDBM50303845 3-(4-Chlorophenyl)-N'-((4-chlorophenyl)sulfonyl)-N-(2-hydroxy-2-methylpropyl)-4-phenyl-4,5-dihydro-1H-pyrazole-1-carboxamidine::CHEMBL569547

SMILES: CC(C)(O)CN=C(NS(=O)(=O)c1ccc(Cl)cc1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1

InChI Key: InChIKey=IYJLQYRDWHVKNY-UHFFFAOYSA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50303845   
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))
BDBM50303845
PNG
(3-(4-Chlorophenyl)-N'-((4-chlorophenyl)sulfonyl)-N...)
Show SMILES CC(C)(O)CN=C(NS(=O)(=O)c1ccc(Cl)cc1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:5.4,c:22|
Show InChI InChI=1S/C26H26Cl2N4O3S/c1-26(2,33)17-29-25(31-36(34,35)22-14-12-21(28)13-15-22)32-16-23(18-6-4-3-5-7-18)24(30-32)19-8-10-20(27)11-9-19/h3-15,23,33H,16-17H2,1-2H3,(H,29,31)
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PC cid
PC sid
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Similars

Article
PubMed
43n/an/an/an/an/an/an/an/a



Solvay Pharma

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO cells


J Med Chem 53: 1338-46 (2010)


Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50303845
PNG
(3-(4-Chlorophenyl)-N'-((4-chlorophenyl)sulfonyl)-N...)
Show SMILES CC(C)(O)CN=C(NS(=O)(=O)c1ccc(Cl)cc1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:5.4,c:22|
Show InChI InChI=1S/C26H26Cl2N4O3S/c1-26(2,33)17-29-25(31-36(34,35)22-14-12-21(28)13-15-22)32-16-23(18-6-4-3-5-7-18)24(30-32)19-8-10-20(27)11-9-19/h3-15,23,33H,16-17H2,1-2H3,(H,29,31)
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]CP55940 from human CB2 receptor expressed in CHO cells


J Med Chem 53: 1338-46 (2010)


Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT
More data for this
Ligand-Target Pair