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BDBM50055737 (1-Benzyl-5-methoxy-2-methyl-1H-indol-3-yl)-acetic acid::1-BENZYL-5-METHOXY-2-METHYL-1H-INDOL-3-YL)-ACETIC ACID::CHEMBL148756

SMILES: COc1ccc2n(Cc3ccccc3)c(C)c(CC(O)=O)c2c1

InChI Key: InChIKey=ZEKCBTQHDTUHRJ-UHFFFAOYSA-N

Data: 1 IC50

PDB links: 1 PDB ID matches this monomer.

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 1 hit for monomerid = 50055737   
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
Phospholipase A2, membrane associated


(Homo sapiens (Human))
BDBM50055737
PNG
((1-Benzyl-5-methoxy-2-methyl-1H-indol-3-yl)-acetic...)
Show SMILES COc1ccc2n(Cc3ccccc3)c(C)c(CC(O)=O)c2c1
Show InChI InChI=1S/C19H19NO3/c1-13-16(11-19(21)22)17-10-15(23-2)8-9-18(17)20(13)12-14-6-4-3-5-7-14/h3-10H,11-12H2,1-2H3,(H,21,22)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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PC sid
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Patents


Similars

MMDB
PDB
Article
PubMed
n/an/a 1.36E+4n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Human Nonpancreatic Secretory Phospholipase A2 through Chromogenic assay


J Med Chem 39: 5119-36 (1997)


Article DOI: 10.1021/jm960485v
BindingDB Entry DOI: 10.7270/Q2542MQ5
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)