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BDBM123738 DCSD 002847 (2)

SMILES: OC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(=O)OCC1c2ccccc2-c2ccccc12

InChI Key: InChIKey=JYUTZJVERLGMQZ-AREMUKBSSA-N

Data: 1 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 1 hit for monomerid = 123738   
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))
BDBM123738
PNG
(DCSD 002847 (2))
Show SMILES OC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(=O)OCC1c2ccccc2-c2ccccc12 |r|
Show InChI InChI=1S/C28H23NO4/c30-27(31)26(16-18-13-14-19-7-1-2-8-20(19)15-18)29-28(32)33-17-25-23-11-5-3-9-21(23)22-10-4-6-12-24(22)25/h1-15,25-26H,16-17H2,(H,29,32)(H,30,31)/t26-/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 8.60E+3n/an/an/an/a8.0n/a



Peking University



Assay Description
The reaction mixture contained 160 uL of reaction buffer [50 mM Tris-HCl (pH 8.0), 100 mM NaCl, 5 ug/mL bovine serum albumin (BSA), 5 uM CaCl2, and 1...


Chem Biol Drug Des 84: 216-22 (2014)


Article DOI: 10.1111/cbdd.12307
BindingDB Entry DOI: 10.7270/Q2NK3CQG
More data for this
Ligand-Target Pair