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BDBM50340321 (R)-1-(4,4-difluoropiperidin-1-yl)-N-(3,3-dimethylbutan-2-yl)imidazo[1,5-a]pyrazine-3-carboxamide::CHEMBL1760941

SMILES: C[C@@H](NC(=O)c1nc(N2CCC(F)(F)CC2)c2cnccn12)C(C)(C)C

InChI Key: InChIKey=IFNYGHXKMOTXNI-STGVRZAANA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50340321   
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))
BDBM50340321
PNG
((R)-1-(4,4-difluoropiperidin-1-yl)-N-(3,3-dimethyl...)
Show SMILES C[C@@H](NC(=O)c1nc(N2CCC(F)(F)CC2)c2cnccn12)C(C)(C)C
Show InChI InChI=1/C18H25F2N5O/c1-12(17(2,3)4)22-16(26)15-23-14(13-11-21-7-10-25(13)15)24-8-5-18(19,20)6-9-24/h7,10-12H,5-6,8-9H2,1-4H3,(H,22,26)/t12-/s2
PDB

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.70E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human CB1 receptor expressed in CHO-K1 cells assessed as inhibition of forskolin-stimulated cAMP level


Bioorg Med Chem Lett 21: 2354-8 (2011)


Article DOI: 10.1016/j.bmcl.2011.02.082
BindingDB Entry DOI: 10.7270/Q2C829MB
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50340321
PNG
((R)-1-(4,4-difluoropiperidin-1-yl)-N-(3,3-dimethyl...)
Show SMILES C[C@@H](NC(=O)c1nc(N2CCC(F)(F)CC2)c2cnccn12)C(C)(C)C
Show InChI InChI=1/C18H25F2N5O/c1-12(17(2,3)4)22-16(26)15-23-14(13-11-21-7-10-25(13)15)24-8-5-18(19,20)6-9-24/h7,10-12H,5-6,8-9H2,1-4H3,(H,22,26)/t12-/s2
PDB

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UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 36n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor expressed in CHO-K1 cells assessed as inhibition of forskolin-stimulated cAMP level


Bioorg Med Chem Lett 21: 2354-8 (2011)


Article DOI: 10.1016/j.bmcl.2011.02.082
BindingDB Entry DOI: 10.7270/Q2C829MB
More data for this
Ligand-Target Pair