Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 323.7 BDBM50487197

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 2 hits in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Protoporphyrinogen oxidase (Homo sapiens (Human))	BDBM50487197 (CHEMBL2252322) Show SMILES CCCOc1cc(N2CC3=C(CCCC3)C2=O)c(F)cc1Cl |t:9| Show InChI InChI=1S/C17H19ClFNO2/c1-2-7-22-16-9-15(14(19)8-13(16)18)20-10-11-5-3-4-6-12(11)17(20)21/h8-9H,2-7,10H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	95	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Central China Normal University Curated by ChEMBL					Assay Description Inhibition of Homo sapiens (human) protoporphyrinogen oxidase				Bioorg Med Chem 18: 7948-56 (2010) Article DOI: 10.1016/j.bmc.2010.09.036 BindingDB Entry DOI: 10.7270/Q2QZ2DT8
					More data for this Ligand-Target Pair
Protoporphyrinogen oxidase (Homo sapiens (Human))	BDBM50487197 (CHEMBL2252322) Show SMILES CCCOc1cc(N2CC3=C(CCCC3)C2=O)c(F)cc1Cl |t:9| Show InChI InChI=1S/C17H19ClFNO2/c1-2-7-22-16-9-15(14(19)8-13(16)18)20-10-11-5-3-4-6-12(11)17(20)21/h8-9H,2-7,10H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	95	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Central China Normal University Curated by ChEMBL					Assay Description Inhibition of Homo sapiens (human) protoporphyrinogen oxidase				Bioorg Med Chem 18: 7948-56 (2010) Article DOI: 10.1016/j.bmc.2010.09.036 BindingDB Entry DOI: 10.7270/Q2QZ2DT8
					More data for this Ligand-Target Pair