BDBM80066 1-(4-methyl-3,5-dinitro-phenyl)-3-pyrroline-2,5-quinone::1-(4-methyl-3,5-dinitro-phenyl)pyrrole-2,5-dione::1-(4-methyl-3,5-dinitrophenyl)pyrrole-2,5-dione::MLS002693528::SMR001559478::cid_248597

SMILES: Cc1c(cc(cc1[N+]([O-])=O)N1C(=O)C=CC1=O)[N+]([O-])=O

InChI Key: InChIKey=LPPHNHBQYKUYHB-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 80066   

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
Beta-galactosidase (Escherichia coli)	BDBM80066 (1-(4-methyl-3,5-dinitro-phenyl)-3-pyrroline-2,5-qu...) Show SMILES Cc1c(cc(cc1[N+]([O-])=O)N1C(=O)C=CC1=O)[N+]([O-])=O |c:14| Show InChI InChI=1S/C11H7N3O6/c1-6-8(13(17)18)4-7(5-9(6)14(19)20)12-10(15)2-3-11(12)16/h2-5H,1H3	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	>6.66E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute(SBMRI, San Diego, C...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2NG4P4X
					More data for this Ligand-Target Pair
hypothetical protein SA1422 (Staphylococcus aureus subsp. aureus N315)	BDBM80066 (1-(4-methyl-3,5-dinitro-phenyl)-3-pyrroline-2,5-qu...) Show SMILES Cc1c(cc(cc1[N+]([O-])=O)N1C(=O)C=CC1=O)[N+]([O-])=O |c:14| Show InChI InChI=1S/C11H7N3O6/c1-6-8(13(17)18)4-7(5-9(6)14(19)20)12-10(15)2-3-11(12)16/h2-5H,1H3	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	6.33E+3	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay									PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q2BV7F7H
					More data for this Ligand-Target Pair
C-C chemokine receptor type 6 (CCR6) (Homo sapiens (Human))	BDBM80066 (1-(4-methyl-3,5-dinitro-phenyl)-3-pyrroline-2,5-qu...) Show SMILES Cc1c(cc(cc1[N+]([O-])=O)N1C(=O)C=CC1=O)[N+]([O-])=O |c:14| Show InChI InChI=1S/C11H7N3O6/c1-6-8(13(17)18)4-7(5-9(6)14(19)20)12-10(15)2-3-11(12)16/h2-5H,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.72E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute(SBMRI, San Diego, CA...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q20P0XHD
					More data for this Ligand-Target Pair