BindingDB PrimarySearch

BDBM23771 (3-{[1-benzyl-3-(carbamoylmethyl)-2-ethyl-1H-indol-5-yl]oxy}propyl)phosphonic acid::CHEMBL146186::LY311727

SMILES: CCc1c(CC(N)=O)c2cc(OCCCP(O)(O)=O)ccc2n1Cc1ccccc1

InChI Key: InChIKey=OPWQYOUZRHDKBR-UHFFFAOYSA-N

Data: 9 IC50

PDB links: 2 PDB IDs match this monomer.

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 9 hits for monomerid = 23771
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Phospholipase A2, membrane associated (Homo sapiens (Human))	BDBM23771 ((3-{[1-benzyl-3-(carbamoylmethyl)-2-ethyl-1H-indol...) Show SMILES Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	470	n/a	n/a	n/a	n/a	7.5	22
Universite Paris 7-Denis Diderot					Assay Description PLA2 activity is by using the fluorescent phospholipid analogue, beta-pyC-10-PG as the substrate. The increase in fluorescence (ex @342 nm and em@388...				Bioorg Med Chem 16: 1242-53 (2008) Article DOI: 10.1016/j.bmc.2007.10.077 BindingDB Entry DOI: 10.7270/Q2J964PK
Universite Paris 7-Denis Diderot					More data for this Ligand-Target Pair				3D Structure (crystal)
Phospholipase A2, major isoenzyme (Sus scrofa (pig))	BDBM23771 ((3-{[1-benzyl-3-(carbamoylmethyl)-2-ethyl-1H-indol...) Show SMILES Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universite Paris 7-Denis Diderot					Assay Description PLA2 activity is by using the fluorescent phospholipid analogue as the substrate. The increase in fluorescence (ex @342 nm and em@388 nm) of the enzy...				Bioorg Med Chem 16: 1242-53 (2008) Article DOI: 10.1016/j.bmc.2007.10.077 BindingDB Entry DOI: 10.7270/Q2J964PK
Universite Paris 7-Denis Diderot					More data for this Ligand-Target Pair
Phospholipase A2, membrane associated (Homo sapiens (Human))	BDBM23771 ((3-{[1-benzyl-3-(carbamoylmethyl)-2-ethyl-1H-indol...) Show SMILES Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	3.55E+4	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Inhibitory activity against porcine pancreatic Phospholipase A2				J Med Chem 39: 5137-58 (1997) Article DOI: 10.1021/jm960486n BindingDB Entry DOI: 10.7270/Q2639NV0
Lilly Research Laboratories Curated by ChEMBL					More data for this Ligand-Target Pair				3D Structure (crystal)
Phospholipase A2, membrane associated (Homo sapiens (Human))	BDBM23771 ((3-{[1-benzyl-3-(carbamoylmethyl)-2-ethyl-1H-indol...) Show SMILES Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	9.11E+4	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Inhibitory activity against human pancreatic Phospholipase A2				J Med Chem 39: 5137-58 (1997) Article DOI: 10.1021/jm960486n BindingDB Entry DOI: 10.7270/Q2639NV0
Lilly Research Laboratories Curated by ChEMBL					More data for this Ligand-Target Pair				3D Structure (crystal)
Phospholipase A2, membrane associated (Homo sapiens (Human))	BDBM23771 ((3-{[1-benzyl-3-(carbamoylmethyl)-2-ethyl-1H-indol...) Show SMILES Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	470	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Diderot Curated by ChEMBL					Assay Description Inhibition of human recombinant group 2A phospholipase A2 by fluorimetric assay				Bioorg Med Chem 18: 3588-600 (2010) Article DOI: 10.1016/j.bmc.2010.03.049 BindingDB Entry DOI: 10.7270/Q2ZG6SD9
Universit£ Paris Diderot Curated by ChEMBL					More data for this Ligand-Target Pair				3D Structure (crystal)
Phospholipase A2, major isoenzyme (Sus scrofa (pig))	BDBM23771 ((3-{[1-benzyl-3-(carbamoylmethyl)-2-ethyl-1H-indol...) Show SMILES Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Université Paris7-Denis Diderot Curated by ChEMBL					Assay Description Inhibition of pig group IB PLA2 by fluorimetric assay				J Med Chem 50: 1618-26 (2007) Article DOI: 10.1021/jm060082n BindingDB Entry DOI: 10.7270/Q2TQ6174
Université Paris7-Denis Diderot Curated by ChEMBL					More data for this Ligand-Target Pair
Phospholipase A2, membrane associated (Homo sapiens (Human))	BDBM23771 ((3-{[1-benzyl-3-(carbamoylmethyl)-2-ethyl-1H-indol...) Show SMILES Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	470	n/a	n/a	n/a	n/a	n/a	n/a
Université Paris7-Denis Diderot Curated by ChEMBL					Assay Description Inhibition of human group IIA PLA2 by fluorimetric assay				J Med Chem 50: 1618-26 (2007) Article DOI: 10.1021/jm060082n BindingDB Entry DOI: 10.7270/Q2TQ6174
Université Paris7-Denis Diderot Curated by ChEMBL					More data for this Ligand-Target Pair				3D Structure (crystal)
Phospholipase A2, major isoenzyme (Sus scrofa (pig))	BDBM23771 ((3-{[1-benzyl-3-(carbamoylmethyl)-2-ethyl-1H-indol...) Show SMILES Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Diderot Curated by ChEMBL					Assay Description Inhibition of porcine group 1B phospholipase A2 by fluorimetric assay				Bioorg Med Chem 18: 3588-600 (2010) Article DOI: 10.1016/j.bmc.2010.03.049 BindingDB Entry DOI: 10.7270/Q2ZG6SD9
Universit£ Paris Diderot Curated by ChEMBL					More data for this Ligand-Target Pair
Phospholipase A2, membrane associated (Homo sapiens (Human))	BDBM23771 ((3-{[1-benzyl-3-(carbamoylmethyl)-2-ethyl-1H-indol...) Show SMILES Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	23	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Inhibition of human non-pancreatic secretory phospholipase A2 (PLA2) in a chromogenic assay				J Med Chem 39: 5137-58 (1997) Article DOI: 10.1021/jm960486n BindingDB Entry DOI: 10.7270/Q2639NV0
Lilly Research Laboratories Curated by ChEMBL					More data for this Ligand-Target Pair				3D Structure (crystal)