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BDBM181116 US9138393, Piperine::US9144538, Piperine

SMILES: CCCN(CC)C(=O)\C=C\C=C\c1ccc2OCOc2c1

InChI Key: InChIKey=DDBOJLPOXHBCQG-KQQUZDAGSA-N

Data: 2 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 181116   
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
Cytochrome P450 3A4


(Homo sapiens (Human))
BDBM181116
PNG
(US9138393, Piperine | US9144538, Piperine)
Show SMILES CCCN(CC)C(=O)\C=C\C=C\c1ccc2OCOc2c1
Show InChI InChI=1S/C17H21NO3/c1-3-11-18(4-2)17(19)8-6-5-7-14-9-10-15-16(12-14)21-13-20-15/h5-10,12H,3-4,11,13H2,1-2H3/b7-5+,8-6+
PDB
MMDB

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PC cid
PC sid
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Similars

US Patent
n/an/a 1.00E+4n/an/an/an/an/an/a



The Procter & Gamble Company

US Patent


Assay Description
Cytochrome P450 is a large and diverse group of enzymes that catalyze the oxidation of organic substances. Some members of the CYP family contribute ...


US Patent US9144538 (2015)


BindingDB Entry DOI: 10.7270/Q22806DV
More data for this
Ligand-Target Pair
Cytochrome P450 3A4


(Homo sapiens (Human))
BDBM181116
PNG
(US9138393, Piperine | US9144538, Piperine)
Show SMILES CCCN(CC)C(=O)\C=C\C=C\c1ccc2OCOc2c1
Show InChI InChI=1S/C17H21NO3/c1-3-11-18(4-2)17(19)8-6-5-7-14-9-10-15-16(12-14)21-13-20-15/h5-10,12H,3-4,11,13H2,1-2H3/b7-5+,8-6+
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 1.00E+4n/an/an/an/an/an/a



The Procter & Gamble Company

US Patent


Assay Description
A commercially available P450-GLO Assay kit (Promega Corporation, Madison Wis.) is used to screen various compounds for CYP3A4A inhibition activity. ...


US Patent US9138393 (2015)


BindingDB Entry DOI: 10.7270/Q2GF0S8J
More data for this
Ligand-Target Pair