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BDBM50176437 CHEMBL381677::N-(6-(4-chlorophenyl)-7-(2,4-dichlorophenyl)-3-isopropyl-1-methyl-2-oxo-1,2-dihydro-1,8-naphthyridin-4-yl)acetamide

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

InChI Key: InChIKey=RNMRJQUHDLMTCB-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50176437   
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))
BDBM50176437
PNG
(CHEMBL381677 | N-(6-(4-chlorophenyl)-7-(2,4-dichlo...)
Show SMILES CC(C)c1c(NC(C)=O)c2cc(-c3ccc(Cl)cc3)c(nc2n(C)c1=O)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C26H22Cl3N3O2/c1-13(2)22-24(30-14(3)33)20-12-19(15-5-7-16(27)8-6-15)23(31-25(20)32(4)26(22)34)18-10-9-17(28)11-21(18)29/h5-13H,1-4H3,(H,30,33)
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Article
PubMed
n/an/a 15n/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))
BDBM50176437
PNG
(CHEMBL381677 | N-(6-(4-chlorophenyl)-7-(2,4-dichlo...)
Show SMILES CC(C)c1c(NC(C)=O)c2cc(-c3ccc(Cl)cc3)c(nc2n(C)c1=O)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C26H22Cl3N3O2/c1-13(2)22-24(30-14(3)33)20-12-19(15-5-7-16(27)8-6-15)23(31-25(20)32(4)26(22)34)18-10-9-17(28)11-21(18)29/h5-13H,1-4H3,(H,30,33)
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PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 5.40E+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