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BDBM50306238 1-(4-(2-amino-2-oxoethyl)-1-(2-chlorophenyl)-5-(4-chlorophenyl)-1H-pyrazole-3-carbonyl)-4-(5-fluoropyridin-2-yl)piperidine-4-carboxylic acid::CHEMBL594159

SMILES: NC(=O)Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccccc1Cl)C(=O)N1CCC(CC1)(C(O)=O)c1ccc(F)cn1

InChI Key: InChIKey=SKHJYMXKKBQLIN-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50306238   
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))
BDBM50306238
PNG
(1-(4-(2-amino-2-oxoethyl)-1-(2-chlorophenyl)-5-(4-...)
Show SMILES NC(=O)Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccccc1Cl)C(=O)N1CCC(CC1)(C(O)=O)c1ccc(F)cn1
Show InChI InChI=1S/C29H24Cl2FN5O4/c30-18-7-5-17(6-8-18)26-20(15-24(33)38)25(35-37(26)22-4-2-1-3-21(22)31)27(39)36-13-11-29(12-14-36,28(40)41)23-10-9-19(32)16-34-23/h1-10,16H,11-15H2,(H2,33,38)(H,40,41)
PDB

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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 30n/an/an/an/an/an/a



7TM Pharma A/S

Curated by ChEMBL


Assay Description
Antagonist activity at human CB1 receptor expressed in CHO-K1 cells assessed as inhibition of CP55940-induced GTPgammaS binding


Bioorg Med Chem Lett 20: 453-7 (2010)


Article DOI: 10.1016/j.bmcl.2009.12.003
BindingDB Entry DOI: 10.7270/Q2MK6D09
More data for this
Ligand-Target Pair