DT-Web

DB04138 - 2,4-Dinitro,5-[Bis(2-Bromoethyl)Amino]-N-(2',3'-Dioxopropyl)Benzamide


Identification
Name 2,4-Dinitro,5-[Bis(2-Bromoethyl)Amino]-N-(2',3'-Dioxopropyl)Benzamide
Accession Number DB04138 (EXPT00668)
Type small molecule
Description Not Available
Structure
MOL SDF PDB SMILES InChI
Categories (*)
Molecular Weight 512.107
Groups experimental
Monoisotopic Weight 509.93857418
Pharmacology
Indication Not Available
Mechanism of action Not Available
Absorption Not Available
Protein binding Not Available
Biotransformation Not Available
Route of elimination Not Available
Toxicity Not Available
Affected organisms Not Available
Interactions
Drug Interactions Not Available
Food Interactions Not Available

Targets


Oxygen-insensitive NAD(P)H nitroreductase
Name Oxygen-insensitive NAD(P)H nitroreductase
Gene Name nfnB
Pharmacological action unknown
Actions Not Available
References
  • Overington JP, Al-Lazikani B, Hopkins AL: How many drug targets are there? Nat Rev Drug Discov. 2006 Dec;5(12):993-6. - Pubmed
  • Imming P, Sinning C, Meyer A: Drugs, their targets and the nature and number of drug targets. Nat Rev Drug Discov. 2006 Oct;5(10):821-34. - Pubmed
DTHybrid score 0.9559

Predictions


Id Partner name Gene Name Score
5184 Oxygen-insensitive NAD(P)H nitroreductase nfnB 0.9559
4407 FMN-dependent NADH-azoreductase azoR 0.1247
5169 FMN-dependent NADH-azoreductase azoR 0.1247
243 Ribosyldihydronicotinamide dehydrogenase [quinone] NQO2 0.1081
2157 NAD(P)H dehydrogenase [quinone] 1 NQO1 0.0649
4366 Riboflavin kinase/FMN adenylyltransferase TM_0857 0.0106
5178 Protein nrdI nrdI 0.0077
5201 FMN-binding protein DvMF_2023 0.0077
5198 Flavodoxin-1 fldA 0.0077
5170 Epidermin decarboxylase epiD 0.0077
5179 Probable aromatic acid decarboxylase pad1 0.0077
5200 NADH dehydrogenase nox 0.0077
3293 Flavodoxin Not Available 0.0077
4614 Flavodoxin DVU_2680 0.0077
5172 Flavodoxin isiB 0.0077
5173 Flavodoxin isiB 0.0077
5182 Flavodoxin fldA 0.0077
5193 Phenazine biosynthesis protein phzG phzG 0.0077
5181 Hypothetical protein yhdA azr 0.0077
5175 Hypothetical protein SMU.260 SMU_260 0.0077
5202 Nitroreductase family protein BC_1844 0.0077
5197 Trp repressor binding protein WrbA, putative DR_A0214 0.0077
5131 PhzG phzG 0.0077
4405 Nitric oxide reductase fprA 0.0077
4037 Hypothetical protein GPX1 0.0077
4297 Hypothetical protein SP_1951 0.0077
4521 Hypothetical protein BC_2969 0.0077
4540 Hypothetical protein TM_1070 0.0077
4555 Hypothetical protein MT1739 0.0077
4569 Hypothetical protein mshD 0.0077
4578 Hypothetical protein PA3270 0.0077
4747 Hypothetical protein PA3967 0.0077
5177 Hypothetical protein TM_0096 0.0077
5194 Hypothetical protein PA1204 0.0077
5240 Hypothetical protein Rv2991 0.0077
5370 Hypothetical protein TM_1158 0.0077
5710 Hypothetical protein Tb927.5.1360 0.0077
2586 Isopentenyl-diphosphate Delta-isomerase idi 0.0077
5187 Isopentenyl-diphosphate delta-isomerase fni 0.0077
5199 Isopentenyl-diphosphate delta-isomerase fni 0.0077
5191 Morphinone reductase morB 0.0077
5190 Rubredoxin-oxygen oxidoreductase roo 0.0077
5206 Phosphopantothenoylcysteine decarboxylase PPCDC 0.0067
4503 NADPH-flavin oxidoreductase frp 0.0067
3507 Chorismate synthase aroC 0.0067
5171 Chorismate synthase aroC 0.0067
5176 YtnJ moxC 0.0067
3766 Pyridoxamine 5'-phosphate oxidase pdxH 0.0067
5189 Trimethylamine dehydrogenase tmd 0.0067
3680 Dihydroorotate dehydrogenase A pyrDA 0.0067
4836 Ferredoxin-dependent glutamate synthase 2 gltS 0.0067
5577 N5-carboxyaminoimidazole ribonucleotide mutase purE 0.0064
5591 Complement component C8 gamma chain C8G 0.0064
3792 KHG/KDPG aldolase [Includes: 4-hydroxy-2-oxoglutarate aldolase eda 0.0064
5582 Regulator of transcription; stringent starvation protein A sspA 0.0064
2838 Ribose-5-phosphate isomerase A rpiA 0.0064
2952 Ribose-5-phosphate isomerase A rpiA 0.0064
5595 Ribose-5-phosphate isomerase A rpiA 0.0064
5598 Glycerol uptake operon antiterminator-related protein TM_1436 0.0064
4238 50S ribosomal protein L4 rplD 0.0064
5578 50S ribosomal protein L4 rplD 0.0064
6173 50S ribosomal protein L4 rplD 0.0064
6219 50S ribosomal protein L4 rplD 0.0064
4695 UPF0124 protein yfiH yfiH 0.0064
5590 N utilization substance protein B homolog nusB 0.0064
5588 Cell division protein FtsY TM_0570 0.0064
5592 Ribonucleoside-diphosphate reductase subunit beta nrdF 0.0064
2300 Lysozyme E 0.0064
3633 Lysozyme R 0.0064
5597 Lysozyme 17 0.0064
5587 Iron(III)-binding periplasmic protein fbpA 0.0064
5593 Transferase Not Available 0.0064
5581 Beta-fructosidase bfrA 0.0063
5060 Intron-associated endonuclease 1 ITEVIR 0.0063
5575 Short tail fiber protein 12 0.0063
5600 Pyruvate decarboxylase pdc 0.0063
5583 RNA 3'-terminal phosphate cyclase rtcA 0.0063
5586 Pleckstrin homology domain-containing family A member 1 PLEKHA1 0.0063
4375 Glutamine synthetase 1 glnA1 0.0063
5580 Hexon protein PII 0.0063
5574 Invasin YPTB1668 0.0063
2775 Dihydroorotate dehydrogenase pyrD 0.0062
6608 Serine/threonine-protein kinase Sgk1 SGK1 0.0062
5180 L(+)-mandelate dehydrogenase mdlB 0.0058
3573 2,4-dienoyl-CoA reductase [NADPH] fadH 0.0058
3085 Molybdopterin-guanine dinucleotide biosynthesis protein A mobA 0.0055
5006 RNASE4 protein RNASE4 0.0055
4533 Glyoxalase family protein BC_1747 0.0055
3132 Tryptophan synthase alpha chain trpA 0.0055
6568 Tryptophan synthase alpha chain trpA 0.0055
4992 Cytochrome c peroxidase Not Available 0.0055
355 GMP synthase [glutamine-hydrolyzing] GMPS 0.0055
4353 GMP synthase [glutamine-hydrolyzing] guaA 0.0055
3729 Citrate synthase gltA 0.0055
4575 Citrate synthase cit 0.0055
4580 Citrate synthase gltA 0.0055
3087 Nicotinate-nucleotide adenylyltransferase nadD 0.0055
4469 Nicotinate-nucleotide adenylyltransferase nadD 0.0055
5599 3-carboxy-cis,cis-muconate cycloisomerase pcaB 0.0055
5328 Prostaglandin F synthase Tb11.02.2310 0.0055
2555 Pol polyprotein pol 0.0055
3242 Pol polyprotein gag-pol 0.0055
3471 Pol polyprotein gag-pro-pol 0.0055
5256 Pol polyprotein pol 0.0055
6469 Pol polyprotein gag-pol 0.0055
6565 Pol polyprotein Not Available 0.0055
408 Riboflavin kinase RFK 0.0055
2261 Major NAD(P)H-flavin oxidoreductase Not Available 0.0055
685 Oxygen-insensitive NADPH nitroreductase nfsA 0.0054
6945 Oxygen-insensitive NADPH nitroreductase rdxA 0.0054
203 Pyridoxine-5'-phosphate oxidase PNPO 0.0053
4284 Pentaerythritol tetranitrate reductase onr 0.0052
2603 Beta-lactamase II blm 0.0051
2149 Angiogenin ANG 0.0051
3583 6-phosphogluconolactonase pgl 0.0051
1467 Tumor necrosis factor ligand superfamily member 13B TNFSF13B 0.0051
4373 Medium-chain-fatty-acid--CoA ligase Not Available 0.0051
2521 Cell division protein ftsZ ftsZ 0.0051
3301 Cell division protein ftsZ ftsZ 0.0051
6268 Hydroxyacid oxidase 1 HAO1 0.0048
3486 Fumarate hydratase class II fumC 0.0048
2942 Sialidase nanH 0.0048
3546 Sialidase nedA 0.0048
2869 1-deoxy-D-xylulose 5-phosphate reductoisomerase dxr 0.0048
2286 Isocitrate dehydrogenase [NADP] icd 0.0048
2302 Isocitrate dehydrogenase [NADP] icd 0.0048
2771 Isocitrate dehydrogenase [NADP] icd 0.0048
654 Flavin reductase BLVRB 0.0047
2805 Heparan sulfate glucosamine 3-O-sulfotransferase 3A1 HS3ST3A1 0.0046
1302 Dihydropyrimidine dehydrogenase [NADP+] DPYD 0.0045
857 Malate dehydrogenase, mitochondrial MDH2 0.0045
1123 Eosinophil cationic protein RNASE3 0.0045
332 Beta-lactamase blaZ 0.0044
2478 Beta-lactamase ampC 0.0044
2613 Beta-lactamase ampC 0.0044
2635 Beta-lactamase ampC 0.0044
2700 Beta-lactamase penP 0.0044
5445 Beta-lactamase blaB 0.0044
6019 Beta-lactamase SHV-7 0.0044
6701 Beta-lactamase cphA 0.0044
941 Betaine--homocysteine S-methyltransferase 1 BHMT 0.0044
2697 Uridine-cytidine kinase 2 UCK2 0.0044
2452 Tryptophanyl-tRNA synthetase trpS 0.0044
5579 Carboxypeptidase B CPB1 0.0042
3384 Macrophage migration inhibitory factor MIF 0.0041
3478 Glucose-1-phosphate thymidylyltransferase rmlA 0.0041
4277 Glucose-1-phosphate thymidylyltransferase rmlA 0.0041
424 Dihydroorotate dehydrogenase, mitochondrial DHODH 0.0039
411 Glycine N-methyltransferase GNMT 0.0039
76 Nitric-oxide synthase, brain NOS1 0.0039
128 Adenine phosphoribosyltransferase APRT 0.0036
4120 NADPH--cytochrome P450 reductase POR 0.0035
5682 Ribonuclease pancreatic RNASE1 0.0032
822 Aldose reductase AKR1B1 0.0032
204 cGMP-specific 3',5'-cyclic phosphodiesterase PDE5A 0.0031
933 Proto-oncogene tyrosine-protein kinase Src SRC 0.003
1632 Solute carrier organic anion transporter family member 2B1 SLCO2B1 0.0024
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