Detailed information for compound 312447

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 262.179 | Formula: C11H17Cl2N3--
  • H donors: 2 H acceptors: 1 LogP: 3.12 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: NCc1ccncc1NC1CCCC1.[Cl-].[Cl-]
  • InChi: 1S/C11H17N3.2ClH/c12-7-9-5-6-13-8-11(9)14-10-3-1-2-4-10;;/h5-6,8,10,14H,1-4,7,12H2;2*1H/p-2
  • InChiKey: YNBSFGYHEBSHMR-UHFFFAOYSA-L  


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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus granulosus Squalene phytoene synthase 0.0084 0.0209 0.0768
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0018 0.0001 0.0002
Toxoplasma gondii lactate dehydrogenase LDH1 0.0883 0.2722 1
Brugia malayi MH2 domain containing protein 0.0129 0.0349 0.1282
Leishmania major malate dehydrogenase, putative 0.0343 0.1024 0.3763
Loa Loa (eye worm) beta-lactamase 0.0035 0.0055 0.0199
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0097 0.0249 0.0249
Brugia malayi Calcitonin receptor-like protein seb-1 0.0056 0.0122 0.0447
Trypanosoma brucei unspecified product 0.0021 0.001 0.0102
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0051 0.0105 0.1022
Brugia malayi beta-lactamase family protein 0.0035 0.0055 0.0201
Trypanosoma brucei DNA polymerase eta, putative 0.0049 0.0098 0.0952
Trypanosoma brucei trypanothione reductase 0.0051 0.0105 0.1022
Schistosoma mansoni aldehyde dehydrogenase 0.0064 0.0147 0.0147
Trichomonas vaginalis CMGC family protein kinase 0.0058 0.0128 0.1248
Mycobacterium ulcerans DNA polymerase IV 0.0021 0.001 0.0102
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0019 0.0004 0.0015
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0116 0.031 0.2632
Leishmania major mitogen activated protein kinase, putative,map kinase, putative 0.0058 0.0128 0.047
Trypanosoma brucei cytosolic malate dehydrogenase 0.0343 0.1024 1
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.0004 0.0015
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.0036 0.0058 0.0211
Entamoeba histolytica malate dehydrogenase, putative 0.0343 0.1024 0.3753
Mycobacterium tuberculosis Probable phytoene synthase PhyA 0.0084 0.0209 0.2042
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0064 0.0147 0.0541
Toxoplasma gondii exonuclease III APE 0.0019 0.0004 0.0015
Schistosoma mansoni L-lactate dehydrogenase 0.0883 0.2722 0.2722
Echinococcus granulosus GPCR family 2 0.0018 0.0001 0.0002
Trypanosoma cruzi DNA polymerase kappa, putative 0.0021 0.001 0.0102
Trichomonas vaginalis penicillin-binding protein, putative 0.0035 0.0055 0.0533
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0064 0.0147 0.0541
Entamoeba histolytica ubiquitin carboxyl-terminal hydrolase domain containing protein 0.0036 0.0058 0.0197
Trypanosoma cruzi cytosolic malate dehydrogenase, putative 0.0343 0.1024 1
Echinococcus granulosus lactate dehydrogenase a 0.0883 0.2722 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0097 0.0249 0.0915
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0034 0.0052 0.0191
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0055 0.0533
Schistosoma mansoni hypothetical protein 0.0707 0.2167 0.2167
Trypanosoma cruzi cytosolic malate dehydrogenase, putative 0.0343 0.1024 1
Trichomonas vaginalis malate dehydrogenase, putative 0.0343 0.1024 1
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0129 0.0351 0.3423
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.0058 0.0128 0.0468
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0019 0.0004 0.0039
Schistosoma mansoni hypothetical protein 0.0018 0.0001 0.0001
Schistosoma mansoni hypothetical protein 0.0206 0.0593 0.0593
Toxoplasma gondii malate dehydrogenase MDH 0.0883 0.2722 1
Echinococcus multilocularis GPCR, family 2 0.0018 0.0001 0.0002
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0019 0.0004 0.0015
Schistosoma mansoni ap endonuclease 0.0019 0.0004 0.0004
Mycobacterium tuberculosis Conserved protein 0.0035 0.0055 0.0533
Echinococcus granulosus neuropeptide s receptor 0.0467 0.1413 0.5191
Schistosoma mansoni DNA polymerase eta 0.0049 0.0098 0.0098
Brugia malayi beta-lactamase 0.0035 0.0055 0.0201
Echinococcus granulosus beta LACTamase domain containing family member 0.0035 0.0055 0.0201
Loa Loa (eye worm) hypothetical protein 0.0049 0.0098 0.0356
Trichomonas vaginalis penicillin-binding protein, putative 0.0035 0.0055 0.0533
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.001 0.0102
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0035 0.0055 0.0533
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.001 0.0102
Trypanosoma cruzi mitochondrial malate dehydrogenase, putative 0.0343 0.1024 1
Trypanosoma cruzi DNA polymerase kappa, putative 0.0021 0.001 0.0102
Trypanosoma cruzi PAB1-binding protein , putative 0.0028 0.0034 0.0333
Trypanosoma cruzi PAB1-binding protein , putative 0.0028 0.0034 0.0333
Trypanosoma cruzi DNA polymerase eta, putative 0.0049 0.0098 0.0952
Brugia malayi ImpB/MucB/SamB family protein 0.0049 0.0098 0.0358
Trichomonas vaginalis malate dehydrogenase, putative 0.0343 0.1024 1
Mycobacterium tuberculosis Probable oxidoreductase 0.0129 0.0351 0.3423
Loa Loa (eye worm) hypothetical protein 0.0148 0.0409 0.1499
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0021 0.001 0.0102
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0019 0.0004 0.0015
Onchocerca volvulus NADH dehydrogenase (ubiquinone) complex I, assembly factor 6 homolog 0.0084 0.0209 1
Trichomonas vaginalis malate dehydrogenase, putative 0.0343 0.1024 1
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0021 0.001 0.0038
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0018 0.0001 0.0002
Loa Loa (eye worm) hypothetical protein 0.0039 0.0066 0.0239
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0097 0.0249 0.0915
Trypanosoma cruzi mitogen activated protein kinase 4, putative 0.0058 0.0128 0.1248
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0235 0.0685 0.2515
Echinococcus granulosus neuropeptide receptor A26 0.0467 0.1413 0.5191
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0019 0.0004 0.0015
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0055 0.0533
Mycobacterium ulcerans DNA polymerase IV 0.0021 0.001 0.0102
Brugia malayi hypothetical protein 0.0018 0.0002 0.0009
Loa Loa (eye worm) hypothetical protein 0.0035 0.0055 0.0199
Schistosoma mansoni hypothetical protein 0.0039 0.0066 0.0066
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0021 0.001 0.0036
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0116 0.031 0.3025
Echinococcus multilocularis geminin 0.0707 0.2167 0.7961
Mycobacterium ulcerans beta-lactamase 0.0035 0.0055 0.0533
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.001 0.0102
Trichomonas vaginalis CMGC family protein kinase 0.0058 0.0128 0.1248
Giardia lamblia Malate dehydrogenase 0.0343 0.1024 1
Brugia malayi exodeoxyribonuclease III family protein 0.0019 0.0004 0.0015
Mycobacterium tuberculosis Conserved protein 0.0035 0.0055 0.0533
Leishmania major mitochondrial malate dehydrogenase 0.0343 0.1024 0.3763
Echinococcus multilocularis neuropeptide s receptor 0.0467 0.1413 0.5191
Trichomonas vaginalis malate dehydrogenase, putative 0.0343 0.1024 1
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0018 0.0001 0.0002
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0035 0.0055 0.0533
Echinococcus granulosus mitogen activated protein kinase 0.0058 0.0128 0.047
Echinococcus multilocularis dna polymerase eta 0.0049 0.0098 0.0358
Toxoplasma gondii thioredoxin reductase 0.0051 0.0105 0.0384
Loa Loa (eye worm) hypothetical protein 0.0036 0.0058 0.0209
Schistosoma mansoni terminal deoxycytidyl transferase 0.0021 0.001 0.001
Mycobacterium tuberculosis Probable reductase 0.0116 0.031 0.3025
Trichomonas vaginalis malate dehydrogenase, putative 0.0343 0.1024 1
Echinococcus granulosus lactate dehydrogenase protein 0.0883 0.2722 1
Plasmodium falciparum glutathione reductase 0.0051 0.0105 0.0384
Schistosoma mansoni hypothetical protein 0.0707 0.2167 0.2167
Trypanosoma cruzi malate dehydrogenase, putative 0.0343 0.1024 1
Loa Loa (eye worm) hypothetical protein 0.0028 0.0034 0.0123
Trypanosoma cruzi squalene synthase, putative 0.027 0.0794 0.7747
Trichomonas vaginalis malate dehydrogenase, putative 0.0343 0.1024 1
Loa Loa (eye worm) thioredoxin reductase 0.0051 0.0105 0.0383
Loa Loa (eye worm) transcription factor SMAD2 0.0129 0.0349 0.128
Trichomonas vaginalis DNA polymerase eta, putative 0.0021 0.001 0.0102
Wolbachia endosymbiont of Brugia malayi malate dehydrogenase 0.0883 0.2722 1
Echinococcus multilocularis muscleblind protein 0.0148 0.0409 0.1501
Trypanosoma cruzi DNA polymerase kappa, putative 0.0021 0.001 0.0102
Echinococcus multilocularis Squalene phytoene synthase 0.0084 0.0209 0.0768
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0035 0.0055 0.0533
Echinococcus multilocularis lactate dehydrogenase a 0.0883 0.2722 1
Trypanosoma brucei DNA polymerase IV, putative 0.0021 0.001 0.0102
Toxoplasma gondii lactate dehydrogenase LDH2 0.0883 0.2722 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.0055 0.0199
Echinococcus multilocularis thioredoxin glutathione reductase 0.0051 0.0105 0.0384
Loa Loa (eye worm) hypothetical protein 0.0084 0.0209 0.0766
Plasmodium falciparum ataxin-2 like protein, putative 0.0028 0.0034 0.0125
Echinococcus granulosus geminin 0.0707 0.2167 0.7961
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 8 0.0036 0.0058 0.0211
Schistosoma mansoni malate dehydrogenase 0.0883 0.2722 0.2722
Trichomonas vaginalis conserved hypothetical protein 0.0036 0.0058 0.0562
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0116 0.031 0.3025
Leishmania major mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440 0.0058 0.0128 0.047
Trypanosoma brucei mitogen activated protein kinase 4, putative 0.0058 0.0128 0.1248
Trichomonas vaginalis malate dehydrogenase, putative 0.0343 0.1024 1
Leishmania major DNA polymerase eta, putative 0.0034 0.0052 0.0191
Brugia malayi MAP kinase sur-1 0.0058 0.0128 0.047
Leishmania major DNA polymerase kappa, putative 0.0021 0.001 0.0038
Loa Loa (eye worm) hypothetical protein 0.0148 0.0409 0.1499
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.001 0.0102
Brugia malayi beta-lactamase family protein 0.0035 0.0055 0.0201
Trypanosoma brucei glycosomal malate dehydrogenase 0.0343 0.1024 1
Echinococcus multilocularis malate dehydrogenase 0.0343 0.1024 0.3763
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0058 0.0128 0.1248
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0019 0.0004 0.0039
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0116 0.031 0.3025
Trypanosoma cruzi DNA polymerase kappa, putative 0.0021 0.001 0.0102
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0019 0.0004 0.0039
Leishmania major hypothetical protein, conserved 0.0028 0.0034 0.0125
Leishmania major squalene synthase, putative 0.027 0.0794 0.2915
Echinococcus granulosus malate dehydrogenase 0.0343 0.1024 0.3763
Echinococcus granulosus malate dehydrogenase 0.0343 0.1024 0.3763
Brugia malayi Thioredoxin reductase 0.0051 0.0105 0.0384
Loa Loa (eye worm) glutathione reductase 0.0051 0.0105 0.0383
Brugia malayi Muscleblind-like protein 0.0148 0.0409 0.1501
Toxoplasma gondii LsmAD domain-containing protein 0.0028 0.0034 0.0125
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0097 0.0249 0.0915
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.001 0.0102
Loa Loa (eye worm) malate dehydrogenase 0.0343 0.1024 0.3761
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0036 0.0058 0.0562
Leishmania major hypothetical protein, conserved 0.0035 0.0055 0.0201
Mycobacterium ulcerans esterase/lipase LipP 0.0035 0.0055 0.0533
Trichomonas vaginalis malate and lactate dehydrogenase, putative 0.0343 0.1024 1
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.0004 0.0015
Echinococcus multilocularis muscleblind protein 1 0.0148 0.0409 0.1501
Loa Loa (eye worm) hypothetical protein 0.0056 0.0122 0.0445
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0021 0.001 0.001
Trypanosoma brucei hypothetical protein, conserved 0.0035 0.0055 0.0533
Trypanosoma brucei protein kinase, putative 0.0058 0.0128 0.1248
Plasmodium vivax lactate dehydrogenase 0.0883 0.2722 1
Mycobacterium tuberculosis Probable malate dehydrogenase Mdh 0.0343 0.1024 1
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0036 0.0058 0.0562
Trypanosoma brucei mitochondrial malate dehydrogenase 0.0343 0.1024 1
Brugia malayi lactate dehydrogenase. 0.0883 0.2722 1
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0021 0.001 0.0038
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0056 0.0122 0.0445
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0035 0.0055 0.0055
Trichomonas vaginalis malate dehydrogenase, putative 0.0343 0.1024 1
Trypanosoma brucei malate dehydrogenase-related 0.0343 0.1024 1
Chlamydia trachomatis malate dehydrogenase 0.0343 0.1024 1
Mycobacterium tuberculosis Probable lipase LipD 0.0035 0.0055 0.0533
Schistosoma mansoni hypothetical protein 0.0018 0.0001 0.0001
Echinococcus granulosus mitogen activated protein kinase 3 0.0058 0.0128 0.047
Schistosoma mansoni malate dehydrogenase 0.0343 0.1024 0.1024
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0055 0.0533
Trypanosoma brucei squalene synthase, putative 0.027 0.0794 0.7747
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0036 0.0058 0.0562
Trichomonas vaginalis malate dehydrogenase, putative 0.0167 0.0471 0.4594
Trypanosoma cruzi glycosomal malate dehydrogenase, putative 0.0343 0.1024 1
Trypanosoma cruzi malate dehydrogenase, putative 0.0343 0.1024 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.001 0.0102
Echinococcus multilocularis lactate dehydrogenase protein 0.0883 0.2722 1
Plasmodium vivax ataxin-2 like protein, putative 0.0028 0.0034 0.0125
Mycobacterium ulcerans aldehyde dehydrogenase 0.0064 0.0147 0.1439
Loa Loa (eye worm) hypothetical protein 0.0883 0.2722 1
Entamoeba histolytica malate dehydrogenase,cytoplasmic, putative 0.0343 0.1024 0.3753
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0097 0.0249 0.0249
Trypanosoma brucei ubiquitin carboxyl-terminal hydrolase, putative 0.0036 0.0058 0.0562
Loa Loa (eye worm) MH2 domain-containing protein 0.0129 0.0349 0.128
Echinococcus multilocularis dna polymerase kappa 0.0021 0.001 0.0038
Toxoplasma gondii ABC1 family protein 0.0035 0.0055 0.0201
Toxoplasma gondii CMGC kinase, MAPK family (ERK) MAPK-1 0.0058 0.0128 0.047
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0018 0.0001 0.0002
Echinococcus multilocularis cytosolic malate dehydrogenase 0.0343 0.1024 0.3763
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0035 0.0055 0.0199
Trichomonas vaginalis esterase, putative 0.0035 0.0055 0.0533
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0056 0.0122 0.0447
Echinococcus multilocularis lactate dehydrogenase a 0.0883 0.2722 1
Trypanosoma cruzi trypanothione reductase, putative 0.0051 0.0105 0.1022
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0019 0.0004 0.0039
Echinococcus multilocularis mitogen activated protein kinase 0.0058 0.0128 0.047
Loa Loa (eye worm) hypothetical protein 0.0035 0.0055 0.0199
Echinococcus granulosus dna polymerase kappa 0.0021 0.001 0.0038
Echinococcus granulosus amiloride sensitive amine oxidase 0.0206 0.0593 0.2178
Echinococcus multilocularis lactate dehydrogenase a 0.0883 0.2722 1
Schistosoma mansoni hypothetical protein 0.0084 0.0209 0.0209
Trypanosoma cruzi mitogen activated protein kinase 2, putative 0.0058 0.0128 0.1248
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0021 0.001 0.0102
Giardia lamblia DINP protein human, muc B family 0.0021 0.001 0.0102
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0019 0.0004 0.0039
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0097 0.0249 0.0914
Echinococcus granulosus cytosolic malate dehydrogenase 0.0343 0.1024 0.3763
Mycobacterium ulcerans aldehyde dehydrogenase 0.0064 0.0147 0.1439
Trichomonas vaginalis CMGC family protein kinase 0.0058 0.0128 0.1248
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0055 0.0533
Plasmodium vivax malate dehydrogenase, putative 0.0883 0.2722 1
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0035 0.0055 0.0533
Trichomonas vaginalis ap endonuclease, putative 0.0019 0.0004 0.0039
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.001 0.0102
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0129 0.0351 0.3053
Brugia malayi Probable malate dehydrogenase, mitochondrial precursor 0.0343 0.1024 0.3763
Trypanosoma cruzi phytoene synthase, putative 0.0084 0.0209 0.2042
Echinococcus multilocularis beta LACTamase domain containing family member 0.0035 0.0055 0.0201
Echinococcus multilocularis L lactate dehydrogenase B chain 0.0883 0.2722 1
Schistosoma mansoni L-lactate dehydrogenase 0.0343 0.1024 0.1024
Schistosoma mansoni ap endonuclease 0.0019 0.0004 0.0004
Echinococcus granulosus lactate dehydrogenase a 0.0883 0.2722 1
Trypanosoma brucei DNA polymerase IV, putative 0.0021 0.001 0.0102
Treponema pallidum exodeoxyribonuclease (exoA) 0.0019 0.0004 1
Leishmania major cytosolic malate dehydrogenase 0.0343 0.1024 0.3763
Trichomonas vaginalis malate dehydrogenase, putative 0.0167 0.0471 0.4594
Echinococcus multilocularis L lactate dehydrogenase 0.054 0.1643 0.6034
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0064 0.0147 0.0541
Echinococcus multilocularis ubiquitin specific protease 41 0.0036 0.0058 0.0211
Schistosoma mansoni hypothetical protein 0.0018 0.0001 0.0001
Brugia malayi follicle stimulating hormone receptor 0.0235 0.0685 0.2516
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0019 0.0004 0.0013
Mycobacterium ulcerans malate dehydrogenase 0.0343 0.1024 1
Loa Loa (eye worm) malate dehydrogenase 0.0343 0.1024 0.3761
Mycobacterium tuberculosis Probable lipase LipE 0.0035 0.0055 0.0533
Trichomonas vaginalis malate dehydrogenase, putative 0.0343 0.1024 1
Trichomonas vaginalis CMGC family protein kinase 0.0058 0.0128 0.1248
Mycobacterium ulcerans phytoene synthase, CrtB 0.0084 0.0209 0.2042
Plasmodium vivax hypothetical protein, conserved 0.0035 0.0055 0.0201
Loa Loa (eye worm) hypothetical protein 0.0035 0.0055 0.0199
Brugia malayi ImpB/MucB/SamB family protein 0.0021 0.001 0.0038
Trichomonas vaginalis malate and lactate dehydrogenase, putative 0.0343 0.1024 1
Giardia lamblia Ubiquitin carboxyl-terminal hydrolase 4 0.0036 0.0058 0.0562
Plasmodium falciparum malate dehydrogenase 0.0883 0.2722 1
Plasmodium vivax glutathione reductase, putative 0.0051 0.0105 0.0384
Mycobacterium ulcerans lipase LipD 0.0035 0.0055 0.0533
Schistosoma mansoni malate dehydrogenase 0.0343 0.1024 0.1024
Trichomonas vaginalis malate and lactate dehydrogenase, putative 0.0343 0.1024 1
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0055 0.0533
Trichomonas vaginalis malate and lactate dehydrogenase, putative 0.0343 0.1024 1
Plasmodium falciparum thioredoxin reductase 0.0051 0.0105 0.0384
Echinococcus multilocularis cytosolic malate dehydrogenase 0.0343 0.1024 0.3763
Echinococcus granulosus dna polymerase eta 0.0049 0.0098 0.0358
Brugia malayi hypothetical protein 0.0028 0.0034 0.0125
Brugia malayi Malate dehydrogenase, cytoplasmic 0.0343 0.1024 0.3763
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0036 0.0058 0.0562
Echinococcus multilocularis amiloride sensitive amine oxidase 0.0206 0.0593 0.2178
Leishmania major malate dehydrogenase 0.0343 0.1024 0.3763
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0224 0.0648 0.6325
Plasmodium vivax lactate/malate dehydrogenase, putative 0.0343 0.1024 0.3763
Trypanosoma cruzi glycosomal malate dehydrogenase, putative 0.0343 0.1024 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.0055 0.0199
Schistosoma mansoni copper/topaquinone oxidase 0.0206 0.0593 0.0593
Leishmania major glycosomal malate dehydrogenase 0.0343 0.1024 0.3763
Loa Loa (eye worm) hypothetical protein 0.0035 0.0055 0.0199
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0116 0.031 0.3025
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.001 0.0102
Mycobacterium tuberculosis Probable dehydrogenase 0.0116 0.031 0.3025
Echinococcus granulosus Peptidase C19 ubiquitin carboxyl terminal hydrolase 2 0.0036 0.0058 0.0211
Schistosoma mansoni ubiquitin-specific peptidase 2 (C19 family) 0.0036 0.0058 0.0058
Mycobacterium tuberculosis Probable hydrolase 0.0035 0.0055 0.0533
Entamoeba histolytica deoxycytidyl transferase, putative 0.0021 0.001 0.0024
Plasmodium falciparum ataxin-2 like protein, putative 0.0028 0.0034 0.0125
Echinococcus granulosus L lactate dehydrogenase 0.054 0.1643 0.6034
Brugia malayi glutathione reductase 0.0051 0.0105 0.0384
Brugia malayi Latrophilin receptor protein 2 0.0018 0.0001 0.0002
Mycobacterium tuberculosis Conserved protein 0.0035 0.0055 0.0533
Trichomonas vaginalis malate dehydrogenase, putative 0.0343 0.1024 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.001 0.0102
Leishmania major DNA polymerase eta, putative 0.0049 0.0098 0.0358
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0035 0.0055 0.0055
Trichomonas vaginalis malate dehydrogenase, putative 0.0343 0.1024 1
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0129 0.0351 0.3423
Echinococcus granulosus ubiquitin specific protease 41 0.0036 0.0058 0.0211
Echinococcus granulosus thioredoxin glutathione reductase 0.0051 0.0105 0.0384
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.001 0.0102
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0097 0.0249 0.0915
Toxoplasma gondii hypothetical protein 0.0104 0.0272 0.1
Trichomonas vaginalis malate dehydrogenase, putative 0.0343 0.1024 1
Echinococcus multilocularis neuropeptide receptor A26 0.0467 0.1413 0.5191
Echinococcus granulosus L lactate dehydrogenase B chain 0.0883 0.2722 1
Echinococcus granulosus cytosolic malate dehydrogenase 0.0343 0.1024 0.3763
Echinococcus granulosus muscleblind protein 0.0148 0.0409 0.1501
Trypanosoma cruzi squalene synthase, putative 0.027 0.0794 0.7747
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0019 0.0004 0.0039
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0058 0.0128 0.1248
Echinococcus multilocularis mitogen activated protein kinase 3 0.0058 0.0128 0.047
Echinococcus multilocularis Peptidase C19, ubiquitin carboxyl terminal hydrolase 2 0.0036 0.0058 0.0211
Echinococcus granulosus ubiquitin carboxyl terminal hydrolase 8 0.0036 0.0058 0.0211
Trypanosoma cruzi DNA polymerase eta, putative 0.0034 0.0052 0.0508
Schistosoma mansoni aldehyde dehydrogenase 0.0064 0.0147 0.0147
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0097 0.0249 0.0915
Mycobacterium tuberculosis Conserved hypothetical protein 0.0021 0.001 0.0102
Trypanosoma brucei PAB1-binding protein , putative 0.0028 0.0034 0.0333
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0035 0.0055 0.0201
Toxoplasma gondii aldehyde dehydrogenase 0.0064 0.0147 0.0541
Giardia lamblia Kinase, CMGC MAPK 0.0058 0.0128 0.1248
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0018 0.0001 0.0002
Leishmania major hypothetical protein, conserved 0.0084 0.0209 0.0768
Mycobacterium tuberculosis Probable esterase LipL 0.0035 0.0055 0.0533
Schistosoma mansoni ubiquitin-specific peptidase 8 (C19 family) 0.0036 0.0058 0.0058
Echinococcus multilocularis malate dehydrogenase 0.0343 0.1024 0.3763
Plasmodium falciparum L-lactate dehydrogenase 0.0883 0.2722 1
Plasmodium falciparum lactate dehydrogenase, putative 0.0343 0.1024 0.3763
Trypanosoma brucei DNA polymerase IV, putative 0.0021 0.001 0.0102
Entamoeba histolytica malate dehydrogenase, putative 0.0883 0.2722 1
Trichomonas vaginalis ap endonuclease, putative 0.0019 0.0004 0.0039
Mycobacterium ulcerans hypothetical protein 0.0035 0.0055 0.0533
Schistosoma mansoni serine/threonine protein kinase 0.0058 0.0128 0.0128
Plasmodium vivax thioredoxin reductase, putative 0.0051 0.0105 0.0384
Schistosoma mansoni family A2 unassigned peptidase (A02 family) 0.0581 0.1773 0.1773
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0021 0.001 0.0038
Brugia malayi latrophilin 2 splice variant baaae 0.0039 0.0066 0.0241
Schistosoma mansoni hypothetical protein 0.0018 0.0001 0.0001
Mycobacterium leprae PROBABLE MALATE DEHYDROGENASE MDH 0.0343 0.1024 1
Schistosoma mansoni malate dehydrogenase 0.0343 0.1024 0.1024
Leishmania major ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative 0.0036 0.0058 0.0211
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0064 0.0147 0.1439
Mycobacterium ulcerans aldehyde dehydrogenase 0.0064 0.0147 0.1439
Leishmania major trypanothione reductase 0.0051 0.0105 0.0384
Leishmania major malate dehydrogenase, putative 0.0883 0.2722 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0097 0.0249 0.0249

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 0.000016 M Inhibition of benzylamine binding to Benzylamine oxidase of porcine serum ChEMBL. 15689151
IC50 (binding) = 0.000019 M Inhibition of putrescine binding to against Diamine oxidase of porcine kidney ChEMBL. 15689151
IC50 (binding) > 0.0001 M Inhibitory concentration for rat liver Monoamine oxidase A using 5-hydroxytryptamine ChEMBL. 15689151
IC50 (binding) > 0.0001 M Inhibitory concentration for rat liver Monoamine oxidase B using beta-phenylethylamine ChEMBL. 15689151
IC50 (binding) = 0.0007 M Inhibition of beta-phenylethylamine binding to Hansenula polymorpha amine oxidase ChEMBL. 15689151

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
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External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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