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BDBM50534279 CHEMBL4468927

SMILES: NC(=O)c1ccc(Cc2ccccc2)cc1-c1cccc(CC(O)=O)c1

InChI Key: InChIKey=BURBMNTYEMRUAU-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50534279   
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))
BDBM50534279
PNG
(CHEMBL4468927)
Show SMILES NC(=O)c1ccc(Cc2ccccc2)cc1-c1cccc(CC(O)=O)c1
Show InChI InChI=1S/C22H19NO3/c23-22(26)19-10-9-17(11-15-5-2-1-3-6-15)13-20(19)18-8-4-7-16(12-18)14-21(24)25/h1-10,12-13H,11,14H2,(H2,23,26)(H,24,25)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 70n/an/an/an/an/an/a



Astrazeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant sPLA2-2A (unknown origin) using 1-palmitoyl-2-oleoyl-sn-glycero-3-phosphocholine as substrate preincubated for 10 mins foll...


ACS Med Chem Lett 7: 884-889 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00188
More data for this
Ligand-Target Pair
Group 10 secretory phospholipase A2


(Homo sapiens (Human))
BDBM50534279
PNG
(CHEMBL4468927)
Show SMILES NC(=O)c1ccc(Cc2ccccc2)cc1-c1cccc(CC(O)=O)c1
Show InChI InChI=1S/C22H19NO3/c23-22(26)19-10-9-17(11-15-5-2-1-3-6-15)13-20(19)18-8-4-7-16(12-18)14-21(24)25/h1-10,12-13H,11,14H2,(H2,23,26)(H,24,25)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.10E+3n/an/an/an/an/an/a



Astrazeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant sPLA2-10 (unknown origin) using 1-palmitoyl-2-oleoyl-sn-glycero-3-phosphocholine as substrate preincubated for 10 mins foll...


ACS Med Chem Lett 7: 884-889 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00188
More data for this
Ligand-Target Pair