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Compile Data Set for Download or QSAR

Found 3 hits of ic50 for monomerid = 50316536   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50316536
PNG
(CHEMBL1095211 | N-[(4R)-6-(4-Chlorophenyl)-7-(2,4-...)
Show SMILES CC1(C)C[C@@H](NC(=O)CC(O)(C(F)(F)F)C(F)(F)F)c2cc(-c3ccc(Cl)cc3)c(nc2O1)-c1ccc(Cl)cc1Cl |r|
Show InChI InChI=1S/C27H21Cl3F6N2O3/c1-24(2)11-20(37-21(39)12-25(40,26(31,32)33)27(34,35)36)18-10-17(13-3-5-14(28)6-4-13)22(38-23(18)41-24)16-8-7-15(29)9-19(16)30/h3-10,20,40H,11-12H2,1-2H3,(H,37,39)/t20-/m1/s1
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Article
PubMed
n/an/a 1.10n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


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


J Med Chem 53: 4028-37 (2010)


Article DOI: 10.1021/jm100023j
BindingDB Entry DOI: 10.7270/Q2TQ61QD
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50316536
PNG
(CHEMBL1095211 | N-[(4R)-6-(4-Chlorophenyl)-7-(2,4-...)
Show SMILES CC1(C)C[C@@H](NC(=O)CC(O)(C(F)(F)F)C(F)(F)F)c2cc(-c3ccc(Cl)cc3)c(nc2O1)-c1ccc(Cl)cc1Cl |r|
Show InChI InChI=1S/C27H21Cl3F6N2O3/c1-24(2)11-20(37-21(39)12-25(40,26(31,32)33)27(34,35)36)18-10-17(13-3-5-14(28)6-4-13)22(38-23(18)41-24)16-8-7-15(29)9-19(16)30/h3-10,20,40H,11-12H2,1-2H3,(H,37,39)/t20-/m1/s1
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Article
PubMed
n/an/a 56n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human recombinant cannabinoid CB2 receptor expressed in CHO cells


J Med Chem 53: 4028-37 (2010)


Article DOI: 10.1021/jm100023j
BindingDB Entry DOI: 10.7270/Q2TQ61QD
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50316536
PNG
(CHEMBL1095211 | N-[(4R)-6-(4-Chlorophenyl)-7-(2,4-...)
Show SMILES CC1(C)C[C@@H](NC(=O)CC(O)(C(F)(F)F)C(F)(F)F)c2cc(-c3ccc(Cl)cc3)c(nc2O1)-c1ccc(Cl)cc1Cl |r|
Show InChI InChI=1S/C27H21Cl3F6N2O3/c1-24(2)11-20(37-21(39)12-25(40,26(31,32)33)27(34,35)36)18-10-17(13-3-5-14(28)6-4-13)22(38-23(18)41-24)16-8-7-15(29)9-19(16)30/h3-10,20,40H,11-12H2,1-2H3,(H,37,39)/t20-/m1/s1
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Article
PubMed
n/an/a>3.00E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [35S]MK499 from human ERG expressed in HEK293 cells


J Med Chem 53: 4028-37 (2010)


Article DOI: 10.1021/jm100023j
BindingDB Entry DOI: 10.7270/Q2TQ61QD
More data for this
Ligand-Target Pair