BDBM33162 (4E)-2,3-dihydroxy-4-[[2-(2-morpholin-4-ylsulfonyl-4-nitrophenyl)hydrazinyl]methylidene]cyclohexa-2,5-dien-1-one::(4E)-2,3-dihydroxy-4-[[N'-(2-morpholinosulfonyl-4-nitro-phenyl)hydrazino]methylene]cyclohexa-2,5-dien-1-one::(4E)-2,3-dihydroxy-4-[[[2-(4-morpholinylsulfonyl)-4-nitrophenyl]hydrazo]methylidene]-1-cyclohexa-2,5-dienone::(4E)-4-[[2-(2-morpholin-4-ylsulfonyl-4-nitro-phenyl)hydrazinyl]methylidene]-2,3-bis(oxidanyl)cyclohexa-2,5-dien-1-one::MLS000336720::SMR000244035::cid_6014955

SMILES: Oc1c([O-])ccc(C[NH+]=Nc2ccc(cc2S(=O)(=O)N2CCOCC2)[N+]([O-])=O)c1O

InChI Key: InChIKey=APSAALPDGKNYKM-UHFFFAOYSA-N

Data: 9 IC50  4 EC50

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 13 hits for monomerid = 33162   

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
Bcl-2-related protein A1 (Homo sapiens (Human))	BDBM33162 ((4E)-2,3-dihydroxy-4-[[2-(2-morpholin-4-ylsulfonyl...) Show SMILES Oc1c([O-])ccc(C[NH+]=Nc2ccc(cc2S(=O)(=O)N2CCOCC2)[N+]([O-])=O)c1O |w:9.9| Show InChI InChI=1S/C17H18N4O8S/c22-14-4-1-11(16(23)17(14)24)10-18-19-13-3-2-12(21(25)26)9-15(13)30(27,28)20-5-7-29-8-6-20/h1-4,9,22-24H,5-8,10H2	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	n/a	n/a	4.48E+3	n/a	n/a	7.4	4
NMMLSC Curated by PubChem BioAssay					Assay Description The multiplex is constructed by using beads for each protein target that have been labeled with varying intensities of red color, so that each assay ...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2CN728N
					More data for this Ligand-Target Pair
MPI protein (Homo sapiens (Human))	BDBM33162 ((4E)-2,3-dihydroxy-4-[[2-(2-morpholin-4-ylsulfonyl...) Show SMILES Oc1c([O-])ccc(C[NH+]=Nc2ccc(cc2S(=O)(=O)N2CCOCC2)[N+]([O-])=O)c1O |w:9.9| Show InChI InChI=1S/C17H18N4O8S/c22-14-4-1-11(16(23)17(14)24)10-18-19-13-3-2-12(21(25)26)9-15(13)30(27,28)20-5-7-29-8-6-20/h1-4,9,22-24H,5-8,10H2	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	7.4	23
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description The purpose of this assay is to identify non-competititve inhibitors of human PMI. This is accomplished by using a G6PD- NADPH-coupled assay. In the ...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2CF9NFM
					More data for this Ligand-Target Pair
glutathione S-transferase (Homo sapiens (Human))	BDBM33162 ((4E)-2,3-dihydroxy-4-[[2-(2-morpholin-4-ylsulfonyl...) Show SMILES Oc1c([O-])ccc(C[NH+]=Nc2ccc(cc2S(=O)(=O)N2CCOCC2)[N+]([O-])=O)c1O |w:9.9| Show InChI InChI=1S/C17H18N4O8S/c22-14-4-1-11(16(23)17(14)24)10-18-19-13-3-2-12(21(25)26)9-15(13)30(27,28)20-5-7-29-8-6-20/h1-4,9,22-24H,5-8,10H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	n/a	n/a	2.40E+4	n/a	n/a	n/a	n/a
NMMLSC Curated by PubChem BioAssay					Assay Description University of New Mexico Assay Overview: Assay Support: NIH 1X01 MH079850-01 HTS to identify small molecule regulators of Bcl-2 family protein int...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2M61HPT
					More data for this Ligand-Target Pair
BCL-W (Homo sapiens (Human))	BDBM33162 ((4E)-2,3-dihydroxy-4-[[2-(2-morpholin-4-ylsulfonyl...) Show SMILES Oc1c([O-])ccc(C[NH+]=Nc2ccc(cc2S(=O)(=O)N2CCOCC2)[N+]([O-])=O)c1O |w:9.9| Show InChI InChI=1S/C17H18N4O8S/c22-14-4-1-11(16(23)17(14)24)10-18-19-13-3-2-12(21(25)26)9-15(13)30(27,28)20-5-7-29-8-6-20/h1-4,9,22-24H,5-8,10H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	n/a	n/a	3.52E+3	n/a	n/a	n/a	n/a
NMMLSC Curated by PubChem BioAssay					Assay Description University of New Mexico Assay Overview: Assay Support: NIH 1X01 MH079850-01 HTS to identify small molecule regulators of Bcl-2 family protein int...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2BR8QM3
					More data for this Ligand-Target Pair
Apoptosis regulator Bcl-2 (Homo sapiens (Human))	BDBM33162 ((4E)-2,3-dihydroxy-4-[[2-(2-morpholin-4-ylsulfonyl...) Show SMILES Oc1c([O-])ccc(C[NH+]=Nc2ccc(cc2S(=O)(=O)N2CCOCC2)[N+]([O-])=O)c1O |w:9.9| Show InChI InChI=1S/C17H18N4O8S/c22-14-4-1-11(16(23)17(14)24)10-18-19-13-3-2-12(21(25)26)9-15(13)30(27,28)20-5-7-29-8-6-20/h1-4,9,22-24H,5-8,10H2	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	n/a	n/a	4.66E+3	n/a	n/a	n/a	n/a
NMMLSC Curated by PubChem BioAssay					Assay Description University of New Mexico Assay Overview: Assay Support: NIH 1X01 MH079850-01 HTS to identify small molecule regulators of Bcl-2 family protein int...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2B27SQ0
					More data for this Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (Homo sapiens (Human))	BDBM33162 ((4E)-2,3-dihydroxy-4-[[2-(2-morpholin-4-ylsulfonyl...) Show SMILES Oc1c([O-])ccc(C[NH+]=Nc2ccc(cc2S(=O)(=O)N2CCOCC2)[N+]([O-])=O)c1O |w:9.9| Show InChI InChI=1S/C17H18N4O8S/c22-14-4-1-11(16(23)17(14)24)10-18-19-13-3-2-12(21(25)26)9-15(13)30(27,28)20-5-7-29-8-6-20/h1-4,9,22-24H,5-8,10H2	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	2.98E+3	n/a	n/a	n/a	n/a	n/a	n/a
Emory University Molecular Libraries Screening Center Curated by PubChem BioAssay					Assay Description NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Nikolovska-Coleska, Univer...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q23X8539
					More data for this Ligand-Target Pair
Caspase-9 (Homo sapiens (Human))	BDBM33162 ((4E)-2,3-dihydroxy-4-[[2-(2-morpholin-4-ylsulfonyl...) Show SMILES Oc1c([O-])ccc(C[NH+]=Nc2ccc(cc2S(=O)(=O)N2CCOCC2)[N+]([O-])=O)c1O |w:9.9| Show InChI InChI=1S/C17H18N4O8S/c22-14-4-1-11(16(23)17(14)24)10-18-19-13-3-2-12(21(25)26)9-15(13)30(27,28)20-5-7-29-8-6-20/h1-4,9,22-24H,5-8,10H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	2.04E+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 (SBIMR, San Diego, C...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q25M647F
					More data for this Ligand-Target Pair
glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase (Plasmodium falciparum 3D7)	BDBM33162 ((4E)-2,3-dihydroxy-4-[[2-(2-morpholin-4-ylsulfonyl...) Show SMILES Oc1c([O-])ccc(C[NH+]=Nc2ccc(cc2S(=O)(=O)N2CCOCC2)[N+]([O-])=O)c1O |w:9.9| Show InChI InChI=1S/C17H18N4O8S/c22-14-4-1-11(16(23)17(14)24)10-18-19-13-3-2-12(21(25)26)9-15(13)30(27,28)20-5-7-29-8-6-20/h1-4,9,22-24H,5-8,10H2	UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	8.74E+3	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/Q2ZS2TZG
					More data for this Ligand-Target Pair
glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase (Plasmodium falciparum 3D7)	BDBM33162 ((4E)-2,3-dihydroxy-4-[[2-(2-morpholin-4-ylsulfonyl...) Show SMILES Oc1c([O-])ccc(C[NH+]=Nc2ccc(cc2S(=O)(=O)N2CCOCC2)[N+]([O-])=O)c1O |w:9.9| Show InChI InChI=1S/C17H18N4O8S/c22-14-4-1-11(16(23)17(14)24)10-18-19-13-3-2-12(21(25)26)9-15(13)30(27,28)20-5-7-29-8-6-20/h1-4,9,22-24H,5-8,10H2	UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	4.75E+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/Q27H1H3W
					More data for this Ligand-Target Pair
glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase (Plasmodium falciparum 3D7)	BDBM33162 ((4E)-2,3-dihydroxy-4-[[2-(2-morpholin-4-ylsulfonyl...) Show SMILES Oc1c([O-])ccc(C[NH+]=Nc2ccc(cc2S(=O)(=O)N2CCOCC2)[N+]([O-])=O)c1O |w:9.9| Show InChI InChI=1S/C17H18N4O8S/c22-14-4-1-11(16(23)17(14)24)10-18-19-13-3-2-12(21(25)26)9-15(13)30(27,28)20-5-7-29-8-6-20/h1-4,9,22-24H,5-8,10H2	UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	7.55E+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/Q23T9FQ1
					More data for this Ligand-Target Pair
Apoptotic peptidase activating factor 1 (Homo sapiens (Human))	BDBM33162 ((4E)-2,3-dihydroxy-4-[[2-(2-morpholin-4-ylsulfonyl...) Show SMILES Oc1c([O-])ccc(C[NH+]=Nc2ccc(cc2S(=O)(=O)N2CCOCC2)[N+]([O-])=O)c1O |w:9.9| Show InChI InChI=1S/C17H18N4O8S/c22-14-4-1-11(16(23)17(14)24)10-18-19-13-3-2-12(21(25)26)9-15(13)30(27,28)20-5-7-29-8-6-20/h1-4,9,22-24H,5-8,10H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	2.14E+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 (SBIMR, San Diego, C...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2JS9NZB
					More data for this Ligand-Target Pair
Apoptotic peptidase activating factor 1 (Homo sapiens (Human))	BDBM33162 ((4E)-2,3-dihydroxy-4-[[2-(2-morpholin-4-ylsulfonyl...) Show SMILES Oc1c([O-])ccc(C[NH+]=Nc2ccc(cc2S(=O)(=O)N2CCOCC2)[N+]([O-])=O)c1O |w:9.9| Show InChI InChI=1S/C17H18N4O8S/c22-14-4-1-11(16(23)17(14)24)10-18-19-13-3-2-12(21(25)26)9-15(13)30(27,28)20-5-7-29-8-6-20/h1-4,9,22-24H,5-8,10H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	>1.00E+5	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 (SBIMR, San Diego, C...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2F18X8S
					More data for this Ligand-Target Pair
Glucose 6-phosphate dehydrogenase (G6PD) (Homo sapiens (Human))	BDBM33162 ((4E)-2,3-dihydroxy-4-[[2-(2-morpholin-4-ylsulfonyl...) Show SMILES Oc1c([O-])ccc(C[NH+]=Nc2ccc(cc2S(=O)(=O)N2CCOCC2)[N+]([O-])=O)c1O |w:9.9| Show InChI InChI=1S/C17H18N4O8S/c22-14-4-1-11(16(23)17(14)24)10-18-19-13-3-2-12(21(25)26)9-15(13)30(27,28)20-5-7-29-8-6-20/h1-4,9,22-24H,5-8,10H2	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	5.56E+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/Q2V12389
					More data for this Ligand-Target Pair