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5 similar compounds to monomer 50431441

Compile data set for download or QSAR
Wt: 314.4
BDBM50431434
Wt: 356.4
BDBM50431437
Wt: 342.4
BDBM50431438
Wt: 314.4
BDBM50431439
Wt: 300.3
BDBM50431440

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50431434,50431437,50431438,50431439,50431440   
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 2


(Homo sapiens (Human))
BDBM50431438
PNG
(CHEMBL2348267)
Show SMILES CCCCCn1c(C)c(C)cc(Oc2nc3ccccc3o2)c1=S
Show InChI InChI=1S/C19H22N2O2S/c1-4-5-8-11-21-14(3)13(2)12-17(18(21)24)23-19-20-15-9-6-7-10-16(15)22-19/h6-7,9-10,12H,4-5,8,11H2,1-3H3
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Article
PubMed
214n/an/an/an/an/an/an/an/a



Shionogi Pharmaceutical Research Center

Curated by ChEMBL


Assay Description
Displacement of [H3]-CP-55940 from human recombinant CB2 receptor expressed in CHO cells


Bioorg Med Chem 21: 2045-55 (2013)


Article DOI: 10.1016/j.bmc.2013.01.006
BindingDB Entry DOI: 10.7270/Q2PG1T2V
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50431434
PNG
(CHEMBL2348271)
Show SMILES CCCCn1cc(C)cc(Oc2nc3ccccc3o2)c1=S
Show InChI InChI=1S/C17H18N2O2S/c1-3-4-9-19-11-12(2)10-15(16(19)22)21-17-18-13-7-5-6-8-14(13)20-17/h5-8,10-11H,3-4,9H2,1-2H3
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PubMed
236n/an/an/an/an/an/an/an/a



Shionogi Pharmaceutical Research Center

Curated by ChEMBL


Assay Description
Displacement of [H3]-CP-55940 from human recombinant CB2 receptor expressed in CHO cells


Bioorg Med Chem 21: 2045-55 (2013)


Article DOI: 10.1016/j.bmc.2013.01.006
BindingDB Entry DOI: 10.7270/Q2PG1T2V
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50431439
PNG
(CHEMBL2348065)
Show SMILES CCCn1c(C)c(C)cc(Oc2nc3ccccc3o2)c1=S
Show InChI InChI=1S/C17H18N2O2S/c1-4-9-19-12(3)11(2)10-15(16(19)22)21-17-18-13-7-5-6-8-14(13)20-17/h5-8,10H,4,9H2,1-3H3
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PubMed
276n/an/an/an/an/an/an/an/a



Shionogi Pharmaceutical Research Center

Curated by ChEMBL


Assay Description
Displacement of [H3]-CP-55940 from human recombinant CB2 receptor expressed in CHO cells


Bioorg Med Chem 21: 2045-55 (2013)


Article DOI: 10.1016/j.bmc.2013.01.006
BindingDB Entry DOI: 10.7270/Q2PG1T2V
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50431437
PNG
(CHEMBL2348268)
Show SMILES CCCCCCn1c(C)c(C)cc(Oc2nc3ccccc3o2)c1=S
Show InChI InChI=1S/C20H24N2O2S/c1-4-5-6-9-12-22-15(3)14(2)13-18(19(22)25)24-20-21-16-10-7-8-11-17(16)23-20/h7-8,10-11,13H,4-6,9,12H2,1-3H3
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PubMed
609n/an/an/an/an/an/an/an/a



Shionogi Pharmaceutical Research Center

Curated by ChEMBL


Assay Description
Displacement of [H3]-CP-55940 from human recombinant CB2 receptor expressed in CHO cells


Bioorg Med Chem 21: 2045-55 (2013)


Article DOI: 10.1016/j.bmc.2013.01.006
BindingDB Entry DOI: 10.7270/Q2PG1T2V
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50431440
PNG
(CHEMBL2348064)
Show SMILES CCn1c(C)c(C)cc(Oc2nc3ccccc3o2)c1=S
Show InChI InChI=1S/C16H16N2O2S/c1-4-18-11(3)10(2)9-14(15(18)21)20-16-17-12-7-5-6-8-13(12)19-16/h5-9H,4H2,1-3H3
PDB

Reactome pathway
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Article
PubMed
3.86E+3n/an/an/an/an/an/an/an/a



Shionogi Pharmaceutical Research Center

Curated by ChEMBL


Assay Description
Displacement of [H3]-CP-55940 from human recombinant CB2 receptor expressed in CHO cells


Bioorg Med Chem 21: 2045-55 (2013)


Article DOI: 10.1016/j.bmc.2013.01.006
BindingDB Entry DOI: 10.7270/Q2PG1T2V
More data for this
Ligand-Target Pair