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SMILES: NC(=O)c1ccc(Cc2ccccc2)cc1-c1cccc(CC(C2CC2)C(O)=O)c1

InChI Key: InChIKey=RRBVXADNZFNDJD-UHFFFAOYSA-N

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 = 50534277   
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))
BDBM50534277
PNG
(CHEMBL4453126)
Show SMILES NC(=O)c1ccc(Cc2ccccc2)cc1-c1cccc(CC(C2CC2)C(O)=O)c1
Show InChI InChI=1S/C26H25NO3/c27-25(28)22-12-9-19(13-17-5-2-1-3-6-17)15-23(22)21-8-4-7-18(14-21)16-24(26(29)30)20-10-11-20/h1-9,12,14-15,20,24H,10-11,13,16H2,(H2,27,28)(H,29,30)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 18n/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))
BDBM50534277
PNG
(CHEMBL4453126)
Show SMILES NC(=O)c1ccc(Cc2ccccc2)cc1-c1cccc(CC(C2CC2)C(O)=O)c1
Show InChI InChI=1S/C26H25NO3/c27-25(28)22-12-9-19(13-17-5-2-1-3-6-17)15-23(22)21-8-4-7-18(14-21)16-24(26(29)30)20-10-11-20/h1-9,12,14-15,20,24H,10-11,13,16H2,(H2,27,28)(H,29,30)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 580n/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