BDBM78899 1-(2-methoxyethyl)-3-[(5-nitro-2-oxidanylidene-indol-3-yl)amino]thiourea::1-(2-methoxyethyl)-3-[(5-nitro-2-oxo-3-indolyl)amino]thiourea::1-(2-methoxyethyl)-3-[(5-nitro-2-oxoindol-3-yl)amino]thiourea::1-[(2-keto-5-nitro-indol-3-yl)amino]-3-(2-methoxyethyl)thiourea::MLS000759991::SMR000370042::cid_6055390

SMILES: COCCNC(=S)N[NH+]=C1C(=O)[N-]c2ccc(cc12)[N+]([O-])=O

InChI Key: InChIKey=DQBNYSGJLUKSSX-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 = 78899   

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
ubiquitin-conjugating enzyme E2 N (Homo sapiens (Human))	BDBM78899 (1-(2-methoxyethyl)-3-[(5-nitro-2-oxidanylidene-ind...) Show SMILES COCCNC(=S)N[NH+]=C1C(=O)[N-]c2ccc(cc12)[N+]([O-])=O |w:8.7| Show InChI InChI=1S/C12H13N5O4S/c1-21-5-4-13-12(22)16-15-10-8-6-7(17(19)20)2-3-9(8)14-11(10)18/h2-3,6H,4-5H2,1H3,(H3,13,14,15,16,18,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	6.15E+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/Q2X34VX0
					More data for this Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N (Homo sapiens (Human))	BDBM78899 (1-(2-methoxyethyl)-3-[(5-nitro-2-oxidanylidene-ind...) Show SMILES COCCNC(=S)N[NH+]=C1C(=O)[N-]c2ccc(cc12)[N+]([O-])=O |w:8.7| Show InChI InChI=1S/C12H13N5O4S/c1-21-5-4-13-12(22)16-15-10-8-6-7(17(19)20)2-3-9(8)14-11(10)18/h2-3,6H,4-5H2,1H3,(H3,13,14,15,16,18,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.52E+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/Q2SB4462
					More data for this Ligand-Target Pair
Bfl-1 (Mus musculus (Mouse))	BDBM78899 (1-(2-methoxyethyl)-3-[(5-nitro-2-oxidanylidene-ind...) Show SMILES COCCNC(=S)N[NH+]=C1C(=O)[N-]c2ccc(cc12)[N+]([O-])=O |w:8.7| Show InChI InChI=1S/C12H13N5O4S/c1-21-5-4-13-12(22)16-15-10-8-6-7(17(19)20)2-3-9(8)14-11(10)18/h2-3,6H,4-5H2,1H3,(H3,13,14,15,16,18,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	>2.00E+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/Q25D8Q92
					More data for this Ligand-Target Pair