BDBM50534280 CHEMBL4591759

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

InChI Key: InChIKey=ALQNEQRTZDZLHJ-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 = 50534280   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Group X secretory phospholipase A2 (Homo sapiens (Human))	BDBM50534280 (CHEMBL4591759) Show SMILES NC(=O)c1ccc(Cc2ccccc2)cc1-c1cccc(CCCC(O)=O)c1 Show InChI InChI=1S/C24H23NO3/c25-24(28)21-13-12-19(14-17-6-2-1-3-7-17)16-22(21)20-10-4-8-18(15-20)9-5-11-23(26)27/h1-4,6-8,10,12-13,15-16H,5,9,11,14H2,(H2,25,28)(H,26,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.40E+3	n/a	n/a	n/a	n/a	n/a	n/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
Phospholipase A2 group IIA (Homo sapiens (Human))	BDBM50534280 (CHEMBL4591759) Show SMILES NC(=O)c1ccc(Cc2ccccc2)cc1-c1cccc(CCCC(O)=O)c1 Show InChI InChI=1S/C24H23NO3/c25-24(28)21-13-12-19(14-17-6-2-1-3-7-17)16-22(21)20-10-4-8-18(15-20)9-5-11-23(26)27/h1-4,6-8,10,12-13,15-16H,5,9,11,14H2,(H2,25,28)(H,26,27)	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/a	n/a	110	n/a	n/a	n/a	n/a	n/a	n/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