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SMILES: CN(C)c1c(NC(C)=O)c2cc(-c3ccc(Cl)cc3)c(nc2n(C)c1=O)-c1ccc(Cl)cc1Cl

InChI Key: InChIKey=FVTHLZNPYMZQAF-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50176436   
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))
BDBM50176436
PNG
(CHEMBL202659 | N-(6-(4-chlorophenyl)-7-(2,4-dichlo...)
Show SMILES CN(C)c1c(NC(C)=O)c2cc(-c3ccc(Cl)cc3)c(nc2n(C)c1=O)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C25H21Cl3N4O2/c1-13(33)29-22-19-12-18(14-5-7-15(26)8-6-14)21(17-10-9-16(27)11-20(17)28)30-24(19)32(4)25(34)23(22)31(2)3/h5-12H,1-4H3,(H,29,33)
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Similars

Article
PubMed
n/an/a 20n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity at the CB1 receptor


Bioorg Med Chem Lett 16: 681-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.10.028
BindingDB Entry DOI: 10.7270/Q2PZ58CM
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50176436
PNG
(CHEMBL202659 | N-(6-(4-chlorophenyl)-7-(2,4-dichlo...)
Show SMILES CN(C)c1c(NC(C)=O)c2cc(-c3ccc(Cl)cc3)c(nc2n(C)c1=O)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C25H21Cl3N4O2/c1-13(33)29-22-19-12-18(14-5-7-15(26)8-6-14)21(17-10-9-16(27)11-20(17)28)30-24(19)32(4)25(34)23(22)31(2)3/h5-12H,1-4H3,(H,29,33)
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antibodypedia
GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 2.50E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity at the CB2 receptor


Bioorg Med Chem Lett 16: 681-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.10.028
BindingDB Entry DOI: 10.7270/Q2PZ58CM
More data for this
Ligand-Target Pair