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BDBM62178 MLS-0019234.0001::N-[(2-keto-6-methyl-1H-quinolin-3-yl)methyl]-N-methyl-picolinamide::N-methyl-N-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]pyridine-2-carboxamide::N-methyl-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-2-pyridinecarboxamide::N-methyl-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]pyridine-2-carboxamide::cid_665054

SMILES: CN(Cc1cc2cc(C)ccc2[nH]c1=O)C(=O)c1ccccn1

InChI Key: InChIKey=UXVPLNYGKBQROQ-UHFFFAOYSA-N

Data: 3 IC50  4 EC50

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 7 hits for monomerid = 62178   
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
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM62178
PNG
(MLS-0019234.0001 | N-[(2-keto-6-methyl-1H-quinolin...)
Show SMILES CN(Cc1cc2cc(C)ccc2[nH]c1=O)C(=O)c1ccccn1
Show InChI InChI=1S/C18H17N3O2/c1-12-6-7-15-13(9-12)10-14(17(22)20-15)11-21(2)18(23)16-5-3-4-8-19-16/h3-10H,11H2,1-2H3,(H,20,22)
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n/an/a>3.20E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2G44NRK
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM62178
PNG
(MLS-0019234.0001 | N-[(2-keto-6-methyl-1H-quinolin...)
Show SMILES CN(Cc1cc2cc(C)ccc2[nH]c1=O)C(=O)c1ccccn1
Show InChI InChI=1S/C18H17N3O2/c1-12-6-7-15-13(9-12)10-14(17(22)20-15)11-21(2)18(23)16-5-3-4-8-19-16/h3-10H,11H2,1-2H3,(H,20,22)
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n/an/a 3.20E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics Source Affiliation: Sanford-Burnham Medical Research Institute Network: NIH Molecular Lib...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q25T3HZB
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM62178
PNG
(MLS-0019234.0001 | N-[(2-keto-6-methyl-1H-quinolin...)
Show SMILES CN(Cc1cc2cc(C)ccc2[nH]c1=O)C(=O)c1ccccn1
Show InChI InChI=1S/C18H17N3O2/c1-12-6-7-15-13(9-12)10-14(17(22)20-15)11-21(2)18(23)16-5-3-4-8-19-16/h3-10H,11H2,1-2H3,(H,20,22)
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n/an/an/an/a>3.20E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2NS0SBF
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM62178
PNG
(MLS-0019234.0001 | N-[(2-keto-6-methyl-1H-quinolin...)
Show SMILES CN(Cc1cc2cc(C)ccc2[nH]c1=O)C(=O)c1ccccn1
Show InChI InChI=1S/C18H17N3O2/c1-12-6-7-15-13(9-12)10-14(17(22)20-15)11-21(2)18(23)16-5-3-4-8-19-16/h3-10H,11H2,1-2H3,(H,20,22)
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n/an/an/an/a 1.00E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2N014Z3
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM62178
PNG
(MLS-0019234.0001 | N-[(2-keto-6-methyl-1H-quinolin...)
Show SMILES CN(Cc1cc2cc(C)ccc2[nH]c1=O)C(=O)c1ccccn1
Show InChI InChI=1S/C18H17N3O2/c1-12-6-7-15-13(9-12)10-14(17(22)20-15)11-21(2)18(23)16-5-3-4-8-19-16/h3-10H,11H2,1-2H3,(H,20,22)
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n/an/an/an/a>3.20E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics Source Affiliation: Sanford-Burnham Medical Research Institute Network: NIH Molecular Lib...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q24T6GTZ
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM62178
PNG
(MLS-0019234.0001 | N-[(2-keto-6-methyl-1H-quinolin...)
Show SMILES CN(Cc1cc2cc(C)ccc2[nH]c1=O)C(=O)c1ccccn1
Show InChI InChI=1S/C18H17N3O2/c1-12-6-7-15-13(9-12)10-14(17(22)20-15)11-21(2)18(23)16-5-3-4-8-19-16/h3-10H,11H2,1-2H3,(H,20,22)
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n/an/an/an/a>3.20E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2125R3Z
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM62178
PNG
(MLS-0019234.0001 | N-[(2-keto-6-methyl-1H-quinolin...)
Show SMILES CN(Cc1cc2cc(C)ccc2[nH]c1=O)C(=O)c1ccccn1
Show InChI InChI=1S/C18H17N3O2/c1-12-6-7-15-13(9-12)10-14(17(22)20-15)11-21(2)18(23)16-5-3-4-8-19-16/h3-10H,11H2,1-2H3,(H,20,22)
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n/an/a 3.20E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q28K77JP
More data for this
Ligand-Target Pair