Detailed information for compound 1180307

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 252.74 | Formula: C13H17ClN2O
  • H donors: 0 H acceptors: 1 LogP: 2.54 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: N#CC(c1cccc(c1)C)N1CCOCC1.Cl
  • InChi: 1S/C13H16N2O.ClH/c1-11-3-2-4-12(9-11)13(10-14)15-5-7-16-8-6-15;/h2-4,9,13H,5-8H2,1H3;1H
  • InChiKey: FTSBRAMJAYSDHN-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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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
Schistosoma mansoni hypothetical protein 0.0349 0.2271 0.2271
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0021 0.0066 0.0176
Echinococcus granulosus Jumonji AT rich interactive domain 1B 0.0011 0.0002 0.0002
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0111 0.0672 0.4329
Brugia malayi hypothetical protein 0.0246 0.1579 0.4177
Onchocerca volvulus 0.005 0.0263 0.3848
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0021 0.0066 0.0066
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0111 0.0672 0.5362
Loa Loa (eye worm) thioredoxin reductase 0.0044 0.022 0.0582
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0021 0.0066 0.0176
Trypanosoma cruzi PAS-domain containing phosphoglycerate kinase, putative 0.0064 0.0357 0.307
Echinococcus granulosus thioredoxin glutathione reductase 0.0044 0.022 0.022
Loa Loa (eye worm) hypothetical protein 0.0021 0.0066 0.0176
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0021 0.0066 0.0066
Echinococcus granulosus carboxylesterase 5A 0.0573 0.3781 0.3781
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0103 0.062 0.164
Loa Loa (eye worm) CXXC zinc finger family protein 0.003 0.0126 0.0334
Brugia malayi F/Y-rich N-terminus family protein 0.0019 0.0053 0.014
Treponema pallidum phosphoglycerate kinase 0.0175 0.1102 1
Mycobacterium ulcerans lipase LipD 0.0037 0.0174 0.1367
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0021 0.0066 0.0066
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0022 0.0072 0.0417
Plasmodium falciparum thioredoxin reductase 0.0015 0.0028 0.0216
Trichomonas vaginalis phosphoglycerate kinase, putative 0.0175 0.1102 1
Onchocerca volvulus 0.0037 0.0174 0.2117
Echinococcus multilocularis importin subunit beta 1 0.003 0.0125 0.0125
Echinococcus granulosus family S9 non peptidase ue S09 family 0.0097 0.0577 0.0577
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial 0.0015 0.0028 0.0216
Schistosoma mansoni aldehyde dehydrogenase 0.0063 0.035 0.035
Schistosoma mansoni thyroid hormone receptor 0.0152 0.095 0.095
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.0015 0.0028 0.0216
Brugia malayi Thioredoxin reductase 0.0044 0.022 0.0582
Loa Loa (eye worm) hypothetical protein 0.0097 0.0577 0.1526
Trypanosoma cruzi trypanothione reductase, putative 0.0044 0.022 0.179
Giardia lamblia PHD finger protein 15 0.003 0.0128 0.093
Schistosoma mansoni cpg binding protein 0.0032 0.0138 0.0138
Schistosoma mansoni neuroligin 3 (S09 family) 0.0097 0.0577 0.0577
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0015 0.0028 0.0073
Echinococcus granulosus snurportin 1 0.0316 0.2054 0.2054
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0131 0.0809 0.0809
Trypanosoma brucei importin beta-1 subunit, putative 0.003 0.0125 0.0907
Brugia malayi Phosphoglycerate kinase 0.0064 0.0357 0.0945
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.01 0.0597 0.3826
Echinococcus granulosus PHD finger protein rhinoceros 0.003 0.0128 0.0128
Echinococcus multilocularis para nitrobenzyl esterase 0.0097 0.0577 0.0577
Loa Loa (eye worm) hypothetical protein 0.0071 0.04 0.1059
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0021 0.0066 0.0066
Trichomonas vaginalis penicillin-binding protein, putative 0.0037 0.0174 0.1367
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0021 0.0066 0.0176
Loa Loa (eye worm) hypothetical protein 0.0021 0.0066 0.0176
Loa Loa (eye worm) hypothetical protein 0.0465 0.3052 0.8071
Mycobacterium tuberculosis Conserved protein 0.0037 0.0174 0.0987
Loa Loa (eye worm) hypothetical protein 0.003 0.0128 0.0337
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0022 0.0072 0.0417
Brugia malayi RNA binding protein 0.0066 0.0369 0.0975
Loa Loa (eye worm) hypothetical protein 0.0097 0.0577 0.1526
Brugia malayi CXXC zinc finger family protein 0.003 0.0126 0.0334
Schistosoma mansoni ap endonuclease 0.002 0.0057 0.0057
Plasmodium falciparum phosphoglycerate kinase 0.0175 0.1102 1
Mycobacterium ulcerans aldehyde dehydrogenase 0.0063 0.035 0.3003
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0021 0.0066 0.0176
Echinococcus granulosus GPCR family 2 0.0033 0.0145 0.0145
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0033 0.0145 0.0145
Schistosoma mansoni hypothetical protein 0.003 0.0128 0.0128
Plasmodium vivax hypothetical protein, conserved 0.003 0.0128 0.1126
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0021 0.0066 0.0176
Echinococcus granulosus tar DNA binding protein 0.0066 0.0369 0.0369
Echinococcus multilocularis GPCR, family 2 0.0033 0.0145 0.0145
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0037 0.0174 0.0987
Echinococcus multilocularis cpg binding protein 0.0032 0.0138 0.0138
Echinococcus granulosus acetylcholinesterase 0.0573 0.3781 0.3781
Loa Loa (eye worm) hypothetical protein 0.0037 0.0174 0.0461
Toxoplasma gondii phosphoglycerate kinase PGKI 0.0175 0.1102 1
Trichomonas vaginalis ran, putative 0.0022 0.0072 0.0417
Echinococcus multilocularis family S9 non peptidase ue (S09 family) 0.0097 0.0577 0.0577
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0015 0.0028 0.0028
Trypanosoma cruzi phosphoglycerate kinase, putative 0.0175 0.1102 1
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.003 0.0128 0.0128
Schistosoma mansoni BC026374 protein (S09 family) 0.0097 0.0577 0.0577
Schistosoma mansoni tar DNA-binding protein 0.0066 0.0369 0.0369
Echinococcus multilocularis survival motor neuron protein 1 0.0246 0.1579 0.1579
Echinococcus multilocularis muscleblind protein 0.0465 0.3052 0.3052
Echinococcus granulosus FTZ F1 alpha 0.0021 0.0066 0.0066
Echinococcus granulosus importin subunit beta 1 0.003 0.0125 0.0125
Toxoplasma gondii thioredoxin reductase 0.0044 0.022 0.179
Trypanosoma brucei phosphoglycerate kinase 0.0175 0.1102 1
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0033 0.0145 0.0145
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 0.0022 0.0072 0.0417
Toxoplasma gondii PHD-finger domain-containing protein 0.003 0.0128 0.093
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.01 0.0597 0.3826
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.005 0.0263 0.0695
Loa Loa (eye worm) hypothetical protein 0.0021 0.0066 0.0176
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0021 0.0066 0.0066
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0037 0.0174 0.0461
Schistosoma mansoni thyroid hormone receptor 0.0152 0.095 0.095
Mycobacterium tuberculosis Carboxylesterase LipT 0.0097 0.0577 0.3693
Loa Loa (eye worm) hypothetical protein 0.0037 0.0174 0.0461
Mycobacterium ulcerans carboxylesterase, LipT 0.0097 0.0577 0.5114
Loa Loa (eye worm) acetylcholinesterase 1 0.0573 0.3781 1
Mycobacterium tuberculosis Probable lipase LipE 0.0037 0.0174 0.0987
Toxoplasma gondii exonuclease III APE 0.002 0.0057 0.0278
Schistosoma mansoni hypothetical protein 0.0316 0.2054 0.2054
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0021 0.0066 0.0066
Mycobacterium tuberculosis Probable dehydrogenase 0.01 0.0597 0.3826
Loa Loa (eye worm) hypothetical protein 0.0012 0.0003 0.0008
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0021 0.0066 0.0066
Plasmodium falciparum phd finger protein, putative 0.003 0.0128 0.1126
Loa Loa (eye worm) hypothetical protein 0.0103 0.062 0.164
Echinococcus granulosus lysine specific demethylase 5A 0.0038 0.0181 0.0181
Echinococcus granulosus peregrin 0.003 0.0128 0.0128
Brugia malayi nuclear hormone receptor 0.0021 0.0066 0.0176
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.002 0.0057 0.0057
Loa Loa (eye worm) TAR-binding protein 0.0066 0.0369 0.0975
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0103 0.062 0.164
Plasmodium vivax glutathione reductase, putative 0.0044 0.022 0.1967
Brugia malayi Muscleblind-like protein 0.0465 0.3052 0.8071
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0024 0.0087 0.0556
Loa Loa (eye worm) hypothetical protein 0.0033 0.0145 0.0385
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0021 0.0066 0.0176
Trypanosoma brucei importin beta-1 subunit, putative 0.003 0.0125 0.0907
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0131 0.0809 0.0809
Plasmodium vivax phosphoglycerate kinase, putative 0.0175 0.1102 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0021 0.0066 0.0176
Brugia malayi Carboxylesterase family protein 0.0097 0.0577 0.1526
Brugia malayi MH2 domain containing protein 0.0117 0.0713 0.1886
Loa Loa (eye worm) hypothetical protein 0.0246 0.1579 0.4177
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0021 0.0066 0.0066
Loa Loa (eye worm) steroid hormone receptor 0.0021 0.0066 0.0176
Trichomonas vaginalis D-aminoacylase, putative 0.0037 0.0174 0.1367
Onchocerca volvulus 0.0097 0.0577 1
Onchocerca volvulus 0.0097 0.0577 1
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0021 0.0066 0.0066
Brugia malayi Carboxylesterase family protein 0.0573 0.3781 1
Trichomonas vaginalis phosphoglycerate kinase, putative 0.0175 0.1102 1
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0021 0.0066 0.0066
Loa Loa (eye worm) hypothetical protein 0.0021 0.0066 0.0176
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0033 0.0145 0.0385
Echinococcus granulosus beta LACTamase domain containing family member 0.0037 0.0174 0.0174
Echinococcus granulosus GTP binding nuclear protein Ran 0.0022 0.0072 0.0072
Mycobacterium ulcerans hypothetical protein 0.0037 0.0174 0.1367
Brugia malayi nuclear receptor NHR-88 0.0021 0.0066 0.0176
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0037 0.0174 0.0174
Trichomonas vaginalis ap endonuclease, putative 0.002 0.0057 0.0278
Brugia malayi Nuclear hormone receptor-like 1 0.0021 0.0066 0.0176
Loa Loa (eye worm) glutathione reductase 0.0044 0.022 0.0582
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.002 0.0057 0.0278
Trypanosoma cruzi importin beta-1 subunit, putative 0.0024 0.0087 0.0556
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0021 0.0066 0.0066
Schistosoma mansoni tar DNA-binding protein 0.0066 0.0369 0.0369
Schistosoma mansoni retinoic acid receptor RXR 0.0021 0.0066 0.0066
Loa Loa (eye worm) jmjC domain-containing protein 0.0062 0.0342 0.0906
Brugia malayi Calcitonin receptor-like protein seb-1 0.0103 0.062 0.164
Entamoeba histolytica hypothetical protein 0.0024 0.0087 0.0286
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0236 0.1515 1
Leishmania major phosphoglycerate kinase C, glycosomal 0.0175 0.1102 1
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0022 0.0072 0.0417
Schistosoma mansoni phosphoglycerate kinase 0.0175 0.1102 0.1102
Echinococcus multilocularis FTZ F1 alpha 0.0021 0.0066 0.0066
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0022 0.0072 0.0072
Loa Loa (eye worm) hypothetical protein 0.0037 0.0174 0.0461
Schistosoma mansoni tar DNA-binding protein 0.0066 0.0369 0.0369
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0021 0.0066 0.0176
Leishmania major importin beta-1 subunit, putative 0.0024 0.0087 0.0556
Schistosoma mansoni cpg binding protein 0.003 0.0126 0.0126
Echinococcus granulosus acetylcholinesterase 0.0573 0.3781 0.3781
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0022 0.0072 0.0624
Brugia malayi Latrophilin receptor protein 2 0.0033 0.0145 0.0385
Loa Loa (eye worm) hypothetical protein 0.0097 0.0577 0.1526
Mycobacterium ulcerans beta-lactamase 0.0037 0.0174 0.1367
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0021 0.0066 0.0066
Echinococcus multilocularis dnaJ subfamily B 0.0425 0.2786 0.2786
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0021 0.0066 0.0176
Echinococcus multilocularis Jumonji, AT rich interactive domain 1B 0.0011 0.0002 0.0002
Echinococcus multilocularis beta LACTamase domain containing family member 0.0037 0.0174 0.0174
Echinococcus granulosus neuroligin 0.0097 0.0577 0.0577
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0022 0.0072 0.0191
Mycobacterium tuberculosis Probable esterase LipL 0.0037 0.0174 0.0987
Trichomonas vaginalis importin beta-1, putative 0.0024 0.0087 0.0556
Echinococcus multilocularis lysine specific demethylase 5A 0.0036 0.017 0.017
Echinococcus multilocularis tar DNA binding protein 0.0066 0.0369 0.0369
Loa Loa (eye worm) hypothetical protein 0.0021 0.0066 0.0176
Schistosoma mansoni jumonji/arid domain-containing protein 0.0038 0.0181 0.0181
Trichomonas vaginalis penicillin-binding protein, putative 0.0037 0.0174 0.1367
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0063 0.035 0.2168
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0098 0.0587 0.0587
Loa Loa (eye worm) hypothetical protein 0.0175 0.1102 0.2915
Plasmodium vivax importin-beta 2, putative 0.003 0.0125 0.1103
Echinococcus multilocularis PHD finger protein rhinoceros 0.003 0.0128 0.0128
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0021 0.0066 0.0176
Echinococcus multilocularis snurportin 1 0.0316 0.2054 0.2054
Loa Loa (eye worm) hypothetical protein 0.003 0.0125 0.0331
Brugia malayi exodeoxyribonuclease III family protein 0.002 0.0057 0.0152
Leishmania major PAS-domain containing phosphoglycerate kinase, putative 0.0064 0.0357 0.307
Trypanosoma cruzi phosphoglycerate kinase, putative 0.0175 0.1102 1
Plasmodium falciparum glutathione reductase 0.0044 0.022 0.1967
Trypanosoma cruzi hypothetical protein, conserved 0.0037 0.0174 0.1367
Brugia malayi Carboxylesterase family protein 0.0097 0.0577 0.1526
Schistosoma mansoni ran 0.0022 0.0072 0.0072
Echinococcus multilocularis ecdysone induced protein 78C 0.0021 0.0066 0.0066
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0037 0.0174 0.0461
Brugia malayi ecdysteroid receptor 0.0021 0.0066 0.0176
Loa Loa (eye worm) hypothetical protein 0.0051 0.0272 0.0719
Mycobacterium ulcerans phosphoglycerate kinase 0.0175 0.1102 1
Trichomonas vaginalis D-aminoacylase, putative 0.0037 0.0174 0.1367
Plasmodium vivax thioredoxin reductase, putative 0.0044 0.022 0.1967
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0037 0.0174 0.0174
Schistosoma mansoni aldehyde dehydrogenase 0.0063 0.035 0.035
Echinococcus granulosus dnaJ subfamily B 0.0425 0.2786 0.2786
Brugia malayi steroid hormone receptor 0.0021 0.0066 0.0176
Echinococcus multilocularis BC026374 protein (S09 family) 0.0097 0.0577 0.0577
Brugia malayi TAR-binding protein 0.0066 0.0369 0.0975
Mycobacterium tuberculosis Putative ferredoxin reductase 0.01 0.0597 0.3826
Onchocerca volvulus Alhambra homolog 0.003 0.0128 0.1197
Giardia lamblia Phosphoglycerate kinase 0.0175 0.1102 1
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0015 0.0028 0.0028
Brugia malayi jmjC domain containing protein 0.0038 0.0181 0.048
Schistosoma mansoni hypothetical protein 0.0033 0.0145 0.0145
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0024 0.0087 0.0556
Loa Loa (eye worm) hypothetical protein 0.0097 0.0577 0.1526
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.002 0.0057 0.0057
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0022 0.0072 0.0624
Toxoplasma gondii phosphoglycerate kinase PGKII 0.0175 0.1102 1
Trypanosoma brucei phosphoglycerate kinase, putative 0.0064 0.0357 0.307
Plasmodium vivax hypothetical protein, conserved 0.0037 0.0174 0.1554
Echinococcus granulosus jumonji domain containing protein 0.0042 0.0207 0.0207
Leishmania major trypanothione reductase 0.0044 0.022 0.179
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0111 0.0672 0.4329
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0063 0.035 0.035
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0021 0.0066 0.0176
Echinococcus multilocularis acetylcholinesterase 0.0573 0.3781 0.3781
Mycobacterium tuberculosis Probable hydrolase 0.0037 0.0174 0.0987
Toxoplasma gondii PHD-finger domain-containing protein 0.003 0.0128 0.093
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0063 0.0352 0.0352
Loa Loa (eye worm) MH2 domain-containing protein 0.0117 0.0713 0.1886
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.002 0.0057 0.0278
Mycobacterium tuberculosis Probable phosphoglycerate kinase Pgk 0.0175 0.1102 0.7221
Schistosoma mansoni ran 0.0022 0.0072 0.0072
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0021 0.0066 0.0176
Schistosoma mansoni hypothetical protein 0.0131 0.0809 0.0809
Loa Loa (eye worm) hypothetical protein 0.0021 0.0066 0.0176
Trypanosoma cruzi phosphoglycerate kinase, putative 0.0064 0.0357 0.307
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0015 0.0028 0.0028
Brugia malayi Phosphoglycerate kinase 0.0175 0.1102 0.2915
Schistosoma mansoni jumonji/arid domain-containing protein 0.0038 0.0181 0.0181
Trypanosoma cruzi phosphoglycerate kinase, putative 0.0064 0.0357 0.307
Echinococcus multilocularis carboxylesterase 5A 0.0573 0.3781 0.3781
Schistosoma mansoni hypothetical protein 0.0071 0.04 0.04
Brugia malayi Steroid receptor seven-up type 2 0.0021 0.0066 0.0176
Chlamydia trachomatis phosphoglycerate kinase 0.0175 0.1102 1
Echinococcus granulosus geminin 0.0349 0.2271 0.2271
Brugia malayi Carboxylesterase family protein 0.0097 0.0577 0.1526
Onchocerca volvulus 0.0097 0.0577 1
Brugia malayi alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase 0.0011 0.0001 0.0001
Schistosoma mansoni nuclear hormone receptor 0.0021 0.0066 0.0066
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.01 0.0597 0.3826
Brugia malayi hypothetical protein 0.0097 0.0577 0.1526
Mycobacterium leprae Probable phosphoglycerate kinase Pgk 0.0175 0.1102 1
Echinococcus multilocularis phosphoglycerate kinase 1 0.0175 0.1102 0.1102
Brugia malayi Bromodomain containing protein 0.003 0.0128 0.0337
Schistosoma mansoni hypothetical protein 0.0033 0.0145 0.0145
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0021 0.0066 0.0066
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast 0.0015 0.0028 0.0216
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.002 0.0057 0.0278
Echinococcus granulosus cpg binding protein 0.0032 0.0138 0.0138
Plasmodium falciparum glutathione reductase 0.0015 0.0028 0.0216
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0021 0.0066 0.0066
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.002 0.0057 0.0488
Schistosoma mansoni tar DNA-binding protein 0.0066 0.0369 0.0369
Trypanosoma cruzi hypothetical protein, conserved 0.0037 0.0174 0.1367
Toxoplasma gondii HEAT repeat-containing protein 0.003 0.0125 0.0907
Loa Loa (eye worm) PHD-finger family protein 0.003 0.0128 0.0337
Loa Loa (eye worm) hypothetical protein 0.0021 0.0066 0.0176
Brugia malayi jmjC domain containing protein 0.0098 0.0587 0.1552
Trypanosoma brucei hypothetical protein, conserved 0.0037 0.0174 0.1367
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.002 0.0057 0.0278
Brugia malayi photoreceptor-specific nuclear receptor 0.0021 0.0066 0.0176
Leishmania major hypothetical protein, conserved 0.0037 0.0174 0.1367
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0037 0.0174 0.0987
Onchocerca volvulus 0.0037 0.0174 0.2117
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0097 0.0577 0.0577
Loa Loa (eye worm) latrophilin receptor protein 2 0.0033 0.0145 0.0385
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0063 0.035 0.035
Echinococcus granulosus phosphoglycerate kinase 1 0.0175 0.1102 0.1102
Echinococcus multilocularis thioredoxin glutathione reductase 0.0044 0.022 0.022
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein 0.0011 0.0001 0.0001
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0021 0.0066 0.0066
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0021 0.0066 0.0066
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.0097 0.0577 0.3693
Brugia malayi latrophilin 2 splice variant baaae 0.0071 0.04 0.1059
Onchocerca volvulus 0.0097 0.0577 1
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0063 0.035 0.3003
Schistosoma mansoni cpg binding protein 0.0032 0.0138 0.0138
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0021 0.0066 0.0066
Brugia malayi RNA recognition motif domain containing protein 0.0066 0.0369 0.0975
Loa Loa (eye worm) carboxylesterase 0.0097 0.0577 0.1526
Loa Loa (eye worm) jmjC domain-containing protein 0.0038 0.0181 0.048
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.002 0.0057 0.0278
Mycobacterium tuberculosis Probable reductase 0.01 0.0597 0.3826
Schistosoma mansoni tar DNA-binding protein 0.0066 0.0369 0.0369
Loa Loa (eye worm) hypothetical protein 0.0465 0.3052 0.8071
Schistosoma mansoni gliotactin 0.0097 0.0577 0.0577
Schistosoma mansoni hypothetical protein 0.0033 0.0145 0.0145
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0033 0.0145 0.0145
Schistosoma mansoni hypothetical protein 0.0349 0.2271 0.2271
Trypanosoma brucei phosphoglycerate kinase 0.0175 0.1102 1
Schistosoma mansoni jumonji domain containing protein 0.0078 0.0451 0.0451
Wolbachia endosymbiont of Brugia malayi phosphoglycerate kinase 0.0175 0.1102 1
Toxoplasma gondii histone lysine methyltransferase SET1 0.0057 0.0306 0.2592
Mycobacterium tuberculosis Probable oxidoreductase 0.0111 0.0672 0.4329
Loa Loa (eye worm) hypothetical protein 0.0097 0.0577 0.1526
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0316 0.2054 0.5433
Onchocerca volvulus 0.0097 0.0577 1
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0017 0.0042 0.0042
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0021 0.0066 0.0176
Echinococcus granulosus para nitrobenzyl esterase 0.0097 0.0577 0.0577
Brugia malayi beta-lactamase family protein 0.0037 0.0174 0.0461
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.002 0.0057 0.0201
Trichomonas vaginalis ap endonuclease, putative 0.002 0.0057 0.0278
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0021 0.0066 0.0176
Schistosoma mansoni ap endonuclease 0.002 0.0057 0.0057
Brugia malayi PHD-finger family protein 0.003 0.0128 0.0337
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0022 0.0072 0.0191
Trypanosoma cruzi 3-phosphoglycerate kinase, glycosomal 0.0064 0.0357 0.307
Schistosoma mansoni phosphoglycerate kinase 0.0175 0.1102 0.1102
Toxoplasma gondii aldehyde dehydrogenase 0.0063 0.035 0.3003
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0021 0.0066 0.0176
Echinococcus multilocularis muscleblind protein 1 0.0465 0.3052 0.3052
Plasmodium falciparum thioredoxin reductase 0.0044 0.022 0.1967
Loa Loa (eye worm) transcription factor SMAD2 0.0117 0.0713 0.1886
Mycobacterium tuberculosis Conserved protein 0.0037 0.0174 0.0987
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.002 0.0057 0.0278
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0033 0.0145 0.0145
Loa Loa (eye worm) hypothetical protein 0.0037 0.0174 0.0461
Loa Loa (eye worm) hypothetical protein 0.0037 0.0174 0.0461
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0021 0.0066 0.0176
Echinococcus multilocularis acetylcholinesterase 0.0573 0.3781 0.3781
Echinococcus granulosus ecdysone induced protein 78C 0.0021 0.0066 0.0066
Echinococcus multilocularis jumonji domain containing protein 0.0042 0.0207 0.0207
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.0097 0.0577 0.3693
Mycobacterium ulcerans aldehyde dehydrogenase 0.0063 0.035 0.3003
Trichomonas vaginalis spcc417.12 protein, putative 0.0097 0.0577 0.5114
Plasmodium falciparum importin beta, putative 0.003 0.0125 0.1103
Entamoeba histolytica phosphoglycerate kinase, putative 0.0175 0.1102 1
Toxoplasma gondii ABC1 family protein 0.0037 0.0174 0.1367
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative 0.0022 0.0072 0.0417
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.01 0.0597 0.4554
Mycobacterium ulcerans esterase/lipase LipP 0.0037 0.0174 0.1367
Schistosoma mansoni RAR-like nuclear receptor 0.0021 0.0066 0.0066
Schistosoma mansoni steroid hormone receptor ad4bp 0.0021 0.0066 0.0066
Mycobacterium tuberculosis Conserved protein 0.0037 0.0174 0.0987
Trichomonas vaginalis carboxylesterase domain containing protein, putative 0.0097 0.0577 0.5114
Schistosoma mansoni survival motor neuron protein 0.005 0.0263 0.0263
Loa Loa (eye worm) carboxylesterase 0.0573 0.3781 1
Brugia malayi glutathione reductase 0.0044 0.022 0.0582
Schistosoma mansoni hypothetical protein 0.0033 0.0145 0.0145
Brugia malayi beta-lactamase family protein 0.0037 0.0174 0.0461
Echinococcus multilocularis peregrin 0.003 0.0128 0.0128
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.002 0.0057 0.0278
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.0015 0.0028 0.0216
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0097 0.0577 0.0577
Echinococcus granulosus survival motor neuron protein 1 0.0246 0.1579 0.1579
Mycobacterium ulcerans aldehyde dehydrogenase 0.0063 0.035 0.3003
Treponema pallidum exodeoxyribonuclease (exoA) 0.002 0.0057 0.0278
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0037 0.0174 0.1367
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0021 0.0066 0.0176
Brugia malayi PHD-finger family protein 0.0012 0.0003 0.0008
Trypanosoma brucei trypanothione reductase 0.0044 0.022 0.179
Onchocerca volvulus 0.003 0.0126 0.1176
Leishmania major GTP-binding protein, putative 0.0022 0.0072 0.0417
Trypanosoma brucei phosphoglycerate kinase 0.0064 0.0357 0.307
Brugia malayi Carboxylesterase family protein 0.0097 0.0577 0.1526
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0573 0.3781 0.3781
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0097 0.0577 0.0577
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0037 0.0174 0.0987
Echinococcus multilocularis neuroligin 0.0097 0.0577 0.0577
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.002 0.0057 0.0488
Schistosoma mansoni coup transcription factor 0.0021 0.0066 0.0066
Schistosoma mansoni hypothetical protein 0.005 0.0263 0.0263
Loa Loa (eye worm) hypothetical protein 0.0097 0.0577 0.1526
Loa Loa (eye worm) carboxylesterase 0.0097 0.0577 0.1526
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0021 0.0066 0.0176
Entamoeba histolytica Ran family GTPase 0.0022 0.0072 0.0143
Leishmania major phosphoglycerate kinase B, cytosolic 0.0175 0.1102 1
Brugia malayi RNA, U transporter 1 0.0084 0.0493 0.1303
Echinococcus multilocularis thyroid hormone receptor alpha 0.0152 0.095 0.095
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0021 0.0066 0.0066
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0098 0.0587 0.0587
Loa Loa (eye worm) hypothetical protein 0.0573 0.3781 1
Echinococcus granulosus muscleblind protein 0.0465 0.3052 0.3052
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.002 0.0057 0.0152
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0021 0.0066 0.0176
Brugia malayi Importin beta-1 subunit 0.003 0.0125 0.0331
Echinococcus multilocularis geminin 0.0349 0.2271 0.2271
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0021 0.0066 0.0176
Brugia malayi Carboxylesterase family protein 0.0573 0.3781 1
Brugia malayi beta-lactamase 0.0037 0.0174 0.0461
Loa Loa (eye worm) hypothetical protein 0.0037 0.0174 0.0461
Mycobacterium tuberculosis Probable lipase LipD 0.0037 0.0174 0.0987
Onchocerca volvulus 0.0037 0.0174 0.2117
Trypanosoma cruzi PAS-domain containing phosphoglycerate kinase, putative 0.0064 0.0357 0.307
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0021 0.0066 0.0066
Schistosoma mansoni acetylcholinesterase 0.0097 0.0577 0.0577
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0066 0.0369 0.0975
Loa Loa (eye worm) beta-lactamase 0.0037 0.0174 0.0461
Trichomonas vaginalis D-aminoacylase, putative 0.0037 0.0174 0.1367
Loa Loa (eye worm) RNA binding protein 0.0066 0.0369 0.0975
Trichomonas vaginalis esterase, putative 0.0037 0.0174 0.1367
Schistosoma mansoni importin beta-1 0.003 0.0125 0.0125
Schistosoma mansoni hypothetical protein 0.0425 0.2786 0.2786
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0044 0.022 0.1292
Loa Loa (eye worm) hypothetical protein 0.0573 0.3781 1
Echinococcus granulosus BC026374 protein S09 family 0.0097 0.0577 0.0577
Loa Loa (eye worm) hypothetical protein 0.0097 0.0577 0.1526
Loa Loa (eye worm) hypothetical protein 0.0021 0.0066 0.0176

Activities

Activity type Activity value Assay description Source Reference
Contraction (functional) % Agonism of Muscarinic acetylcholine receptor M3 was determined as maximal contraction rate of isolated guinea pig ileum ChEMBL. 15149637
Relaxation (functional) = 30 % Agonism of endothelin A receptor was determined as maximal rate of vascular endothelium-dependent relaxation at the concentration of 10E-5 M/L; 20-30% ChEMBL. 15149637

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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