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BDBM50136443 5-Methyl-1H-indole-2-carboxylic acid (1-methyl-2-oxo-1,2,3,4-tetrahydro-quinolin-3-yl)-amide::CHEMBL136572

SMILES: CN1C(=O)C(Cc2ccccc12)NC(=O)c1cc2cc(C)ccc2[nH]1

InChI Key: InChIKey=NMGYSFGHNOFZJC-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50136443   
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
Muscle glycogen phosphorylase


(Homo sapiens (Human))
BDBM50136443
PNG
(5-Methyl-1H-indole-2-carboxylic acid (1-methyl-2-o...)
Show SMILES CN1C(=O)C(Cc2ccccc12)NC(=O)c1cc2cc(C)ccc2[nH]1
Show InChI InChI=1S/C20H19N3O2/c1-12-7-8-15-14(9-12)11-16(21-15)19(24)22-17-10-13-5-3-4-6-18(13)23(2)20(17)25/h3-9,11,17,21H,10H2,1-2H3,(H,22,24)
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PC cid
PC sid
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Similars

PubMed
n/an/a 98n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibitory concentration against recombinant human muscle glycogen phosphorylase a (HMGPa)


Bioorg Med Chem Lett 13: 4385-8 (2003)


BindingDB Entry DOI: 10.7270/Q2S75FQV
More data for this
Ligand-Target Pair
Glycogen Phosphorylase (PYGL)


(Homo sapiens (Human))
BDBM50136443
PNG
(5-Methyl-1H-indole-2-carboxylic acid (1-methyl-2-o...)
Show SMILES CN1C(=O)C(Cc2ccccc12)NC(=O)c1cc2cc(C)ccc2[nH]1
Show InChI InChI=1S/C20H19N3O2/c1-12-7-8-15-14(9-12)11-16(21-15)19(24)22-17-10-13-5-3-4-6-18(13)23(2)20(17)25/h3-9,11,17,21H,10H2,1-2H3,(H,22,24)
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Article
PubMed
n/an/a 120n/an/an/an/an/an/a



Applied Science University

Curated by ChEMBL


Assay Description
Inhibition of human liver glycogen phosphorylase 1a assessed as release of phosphate from glucose-1- phosphate after 20 mins


Bioorg Med Chem 19: 4746-71 (2011)


Article DOI: 10.1016/j.bmc.2011.06.086
BindingDB Entry DOI: 10.7270/Q2028RXJ
More data for this
Ligand-Target Pair
Glycogen Phosphorylase (PYGL)


(Homo sapiens (Human))
BDBM50136443
PNG
(5-Methyl-1H-indole-2-carboxylic acid (1-methyl-2-o...)
Show SMILES CN1C(=O)C(Cc2ccccc12)NC(=O)c1cc2cc(C)ccc2[nH]1
Show InChI InChI=1S/C20H19N3O2/c1-12-7-8-15-14(9-12)11-16(21-15)19(24)22-17-10-13-5-3-4-6-18(13)23(2)20(17)25/h3-9,11,17,21H,10H2,1-2H3,(H,22,24)
PDB
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KEGG

UniProtKB/SwissProt

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antibodypedia
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CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 120n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibitory concentration against recombinant human liver glycogen phosphorylase a (HLGPa)


Bioorg Med Chem Lett 13: 4385-8 (2003)


BindingDB Entry DOI: 10.7270/Q2S75FQV
More data for this
Ligand-Target Pair