Detailed information for compound 1420671

Basic information

Technical information
  • TDR Targets ID: 1420671
  • Name: N-(2-diethylaminoethyl)-2-(1H-imidazole-2-car bonyl)benzamide
  • MW: 314.382 | Formula: C17H22N4O2
  • H donors: 2 H acceptors: 3 LogP: 1.79 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCN(CCNC(=O)c1ccccc1C(=O)c1ncc[nH]1)CC
  • InChi: 1S/C17H22N4O2/c1-3-21(4-2)12-11-20-17(23)14-8-6-5-7-13(14)15(22)16-18-9-10-19-16/h5-10H,3-4,11-12H2,1-2H3,(H,18,19)(H,20,23)
  • InChiKey: USRDNNJTZJGRBH-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-(2-diethylaminoethyl)-2-(1H-imidazol-2-yl-oxomethyl)benzamide
  • N-(2-diethylaminoethyl)-2-(1H-imidazol-2-ylcarbonyl)benzamide
  • SMR000105350
  • BIM-0030407.P001
  • CBMicro_030535
  • A1843/0077535
  • MLS000109407

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens lysine (K)-specific demethylase 4A Starlite/ChEMBL No references
Homo sapiens GNAS complex locus Starlite/ChEMBL No references
Rattus norvegicus Inositol monophosphatase 1 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase Get druggable targets OG5_126810 All targets in OG5_126810
Schistosoma japonicum ko:K01092 myo-inositol-1(or 4)-monophosphatase [EC3.1.3.25], putative Get druggable targets OG5_126810 All targets in OG5_126810
Trypanosoma congolense inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Candida albicans one of two closely related potential jumonji-like transcription factor genes similar to S. cerevisiae RPH1 (YER169W) damage-resp Get druggable targets OG5_127917 All targets in OG5_127917
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative Get druggable targets OG5_126810 All targets in OG5_126810
Candida albicans one of two closely related potential jumonji-like transcription factor genes similar to S. cerevisiae RPH1 (YER169W) damage-resp Get druggable targets OG5_127917 All targets in OG5_127917
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus multilocularis Transcription factor, JmjC domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Echinococcus granulosus inositol monophosphatase 1 Get druggable targets OG5_126810 All targets in OG5_126810
Loa Loa (eye worm) jmjC domain-containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). Get druggable targets OG5_126810 All targets in OG5_126810
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Candida albicans one of two closely related potential jumonji-like transcription factor genes similar to S. cerevisiae RPH1 (YER169W) damage-resp Get druggable targets OG5_127917 All targets in OG5_127917
Leishmania infantum myo-inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni inositol monophosphatase Get druggable targets OG5_126810 All targets in OG5_126810
Leishmania mexicana myo-inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Plasmodium yoelii hypothetical protein Get druggable targets OG5_127917 All targets in OG5_127917
Echinococcus multilocularis inositol monophosphatase 1 Get druggable targets OG5_126810 All targets in OG5_126810
Trypanosoma brucei gambiense inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Echinococcus multilocularis jumonji domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Mycobacterium ulcerans extragenic suppressor protein SuhB Get druggable targets OG5_126810 All targets in OG5_126810
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Trichomonas vaginalis inositol monophosphatase, putative Get druggable targets OG5_126810 All targets in OG5_126810
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB Get druggable targets OG5_126810 All targets in OG5_126810
Trichomonas vaginalis myo inositol monophosphatase, putative Get druggable targets OG5_126810 All targets in OG5_126810
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Leishmania donovani myo-inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Loa Loa (eye worm) inositol-1 Get druggable targets OG5_126810 All targets in OG5_126810
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127917 All targets in OG5_127917
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Neospora caninum hypothetical protein Get druggable targets OG5_126810 All targets in OG5_126810
Schistosoma japonicum JmjC domain-containing histone demethylation protein 3C, putative Get druggable targets OG5_127917 All targets in OG5_127917
Schistosoma mansoni inositol monophosphatase Get druggable targets OG5_126810 All targets in OG5_126810
Echinococcus granulosus jumonji domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Entamoeba histolytica myo-inositol monophosphatase, putative Get druggable targets OG5_126810 All targets in OG5_126810
Schistosoma japonicum ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative Get druggable targets OG5_131088 All targets in OG5_131088
Candida albicans one of two closely related potential jumonji-like transcription factor genes similar to S. cerevisiae RPH1 (YER169W) damage-resp Get druggable targets OG5_127917 All targets in OG5_127917
Brugia malayi Inositol-1 Get druggable targets OG5_126810 All targets in OG5_126810
Echinococcus granulosus Transcription factor JmjC domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Schistosoma japonicum expressed protein Get druggable targets OG5_127917 All targets in OG5_127917
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Leishmania braziliensis myo-inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Brugia malayi jmjC domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Schistosoma japonicum expressed protein Get druggable targets OG5_127917 All targets in OG5_127917
Schistosoma japonicum Probable JmjC domain-containing histone demethylation protein 3B, putative Get druggable targets OG5_127917 All targets in OG5_127917
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative Get druggable targets OG5_126810 All targets in OG5_126810
Schistosoma mansoni jumonji domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Trichomonas vaginalis myo inositol monophosphatase, putative Get druggable targets OG5_126810 All targets in OG5_126810
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Dictyostelium discoideum 3',5'-bisphosphate nucleotidase 1 Inositol monophosphatase 1   277 aa 275 aa 22.2 %
Trypanosoma cruzi myo-inositol-1 phosphatase, putative Inositol monophosphatase 1   277 aa 284 aa 30.6 %
Candida albicans one of two closely related genes similar to S. cerevisiae MET22/HAL2 (YOL064C) bisphosphate-3'-nucleotidase, implicated in salt Inositol monophosphatase 1   277 aa 306 aa 22.5 %
Schistosoma mansoni GTP-binding protein alpha subunit gna GNAS complex locus 394 aa 450 aa 28.7 %
Onchocerca volvulus Inositol monophosphatase 1   277 aa 238 aa 22.7 %
Trichomonas vaginalis inositol monophosphatase, putative Inositol monophosphatase 1   277 aa 268 aa 22.4 %
Entamoeba histolytica 3(2),5-bisphosphate nucleotidase, putative Inositol monophosphatase 1   277 aa 263 aa 24.0 %
Trichomonas vaginalis diphosphonucleoside phosphohydrolase, putative Inositol monophosphatase 1   277 aa 263 aa 21.7 %
Candida albicans one of two closely related genes similar to S. cerevisiae MET22/HAL2 (YOL064C) bisphosphate-3'-nucleotidase, implicated in salt Inositol monophosphatase 1   277 aa 307 aa 22.5 %
Trypanosoma cruzi inositol polyphosphate 1-phosphatase, putative Inositol monophosphatase 1   277 aa 291 aa 23.7 %
Trypanosoma congolense inositol-1(or 4)-monophosphatase, putative Inositol monophosphatase 1   277 aa 304 aa 28.9 %
Dictyostelium discoideum 3',5'-bisphosphate nucleotidase Inositol monophosphatase 1   277 aa 230 aa 25.2 %
Trypanosoma brucei gambiense inositol-1(or 4)-monophosphatase, putative Inositol monophosphatase 1   277 aa 309 aa 27.8 %
Onchocerca volvulus Putative 28S ribosomal protein S10, mitochondrial Inositol monophosphatase 1   277 aa 271 aa 46.1 %
Trichomonas vaginalis inositol monophosphatase, putative Inositol monophosphatase 1   277 aa 258 aa 21.7 %
Candida albicans one of two closely related genes similar to S. cerevisiae MET22/HAL2 (YOL064C) bisphosphate-3'-nucleotidase, implicated in salt Inositol monophosphatase 1   277 aa 300 aa 22.0 %
Schistosoma japonicum ko:K01082 3'(2'), 5'-bisphosphate nucleotidase [EC3.1.3.7], putative Inositol monophosphatase 1   277 aa 275 aa 21.5 %
Brugia malayi Inositol monophosphatase family protein Inositol monophosphatase 1   277 aa 238 aa 21.8 %
Entamoeba histolytica 3(2),5-bisphosphate nucleotidase, putative Inositol monophosphatase 1   277 aa 287 aa 22.3 %
Loa Loa (eye worm) hypothetical protein Inositol monophosphatase 1   277 aa 298 aa 23.8 %
Trichomonas vaginalis myo inositol monophosphatase, putative Inositol monophosphatase 1   277 aa 276 aa 21.4 %
Trypanosoma brucei inositol-1(or 4)-monophosphatase, putative Inositol monophosphatase 1   277 aa 304 aa 27.3 %
Schistosoma mansoni pap-inositol-14-phosphatase Inositol monophosphatase 1   277 aa 279 aa 22.9 %
Onchocerca volvulus Putative trans-2-enoyl-CoA reductase 1, mitochondrial Inositol monophosphatase 1   277 aa 278 aa 23.0 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Brugia malayi jmjC domain containing protein 0.0115 0.1433 0.1433
Loa Loa (eye worm) solute carrier family 6 member 4 0.0034 0.0044 0.0044
Echinococcus granulosus Smad4 0.0042 0.0178 0.0667
Echinococcus multilocularis uncharacterized sodium dependent transporter 0.0034 0.0044 0.0163
Loa Loa (eye worm) hypothetical protein 0.0173 0.2415 0.2415
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0045 0.0223 0.5
Loa Loa (eye worm) TAR-binding protein 0.0188 0.2669 0.2669
Plasmodium falciparum transporter, putative 0.0034 0.0044 0.0211
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0034 0.0044 0.0163
Loa Loa (eye worm) hypothetical protein 0.0034 0.0044 0.0044
Trichomonas vaginalis acetylornithine aminotransferase, putative 0.0149 0.2005 1
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.008 0.0828 0.3101
Schistosoma mansoni inositol monophosphatase 0.0045 0.0223 0.0836
Mycobacterium ulcerans adenosylmethionine-8-amino-7-oxononanoate aminotransferase 0.0149 0.2005 1
Brugia malayi Latrophilin receptor protein 2 0.008 0.0828 0.0828
Loa Loa (eye worm) jmjC domain-containing protein 0.0043 0.0189 0.0189
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0405 0.1518
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0045 0.0223 0.5
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0045 0.0223 0.1082
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0188 0.2669 0.2669
Mycobacterium tuberculosis Adenosylmethionine-8-amino-7-oxononanoate aminotransferase BioA 0.0149 0.2005 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.0253 0.3783 0.3783
Plasmodium vivax ataxin-2 like protein, putative 0.0152 0.2063 1
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0045 0.0223 0.1082
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.0405 0.1518
Trypanosoma cruzi PAB1-binding protein , putative 0.0152 0.2063 1
Brugia malayi PHD-finger family protein 0.0035 0.0062 0.0062
Schistosoma mansoni hypothetical protein 0.0035 0.0062 0.0234
Schistosoma mansoni hypothetical protein 0.008 0.0828 0.3101
Plasmodium vivax amine transporter, putative 0.0034 0.0044 0.0211
Schistosoma mansoni jumonji domain containing protein 0.0092 0.1027 0.3849
Brugia malayi Inositol-1 0.0045 0.0223 0.0223
Echinococcus granulosus lysine specific demethylase 5A 0.0043 0.0189 0.0709
Echinococcus multilocularis sodium dependent neurotransmitter transporter 0.0034 0.0044 0.0163
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.0405 0.1518
Echinococcus multilocularis lysine specific demethylase 5A 0.0043 0.0189 0.0709
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0035 0.0062 0.0234
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0034 0.0044 0.0044
Schistosoma mansoni smad1 5 8 and 0.0042 0.0178 0.0667
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0034 0.0044 0.0211
Brugia malayi MH1 domain containing protein 0.0042 0.0178 0.0178
Echinococcus granulosus inositol monophosphatase 1 0.0045 0.0223 0.0836
Loa Loa (eye worm) hypothetical protein 0.0034 0.0044 0.0044
Schistosoma mansoni hypothetical protein 0.008 0.0828 0.3101
Echinococcus granulosus smad 0.0042 0.0178 0.0667
Echinococcus granulosus serotonin transporter 0.0034 0.0044 0.0163
Plasmodium falciparum phd finger protein, putative 0.0035 0.0062 0.0302
Loa Loa (eye worm) Sodium:neurotransmitter symporter family protein 0.0034 0.0044 0.0044
Schistosoma mansoni tar DNA-binding protein 0.0188 0.2669 1
Schistosoma mansoni jumonji/arid domain-containing protein 0.0043 0.0189 0.0709
Loa Loa (eye worm) hypothetical protein 0.0034 0.0044 0.0044
Echinococcus multilocularis sodium:chloride dependent neurotransmitter 0.0034 0.0044 0.0163
Mycobacterium leprae PROBABLE ADENOSYLMETHIONINE-8-AMINO-7-OXONONANOATE AMINOTRANSFERASE BIOA 0.0149 0.2005 1
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.008 0.0828 0.0828
Echinococcus multilocularis serotonin transporter 0.0034 0.0044 0.0163
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.0405 0.1518
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0045 0.0223 0.1082
Schistosoma mansoni tar DNA-binding protein 0.0188 0.2669 1
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0034 0.0044 0.0163
Loa Loa (eye worm) hypothetical protein 0.0175 0.2459 0.2459
Brugia malayi TAR-binding protein 0.0188 0.2669 0.2669
Schistosoma mansoni hypothetical protein 0.008 0.0828 0.3101
Echinococcus granulosus sodium:chloride dependent neurotransmitter 0.0034 0.0044 0.0163
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0045 0.0223 0.1082
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0115 0.1433 0.5368
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0034 0.0044 0.0044
Schistosoma mansoni hypothetical protein 0.008 0.0828 0.3101
Loa Loa (eye worm) MH2 domain-containing protein 0.0616 1 1
Toxoplasma gondii hypothetical protein 0.0034 0.0044 0.0211
Schistosoma mansoni tar DNA-binding protein 0.0188 0.2669 1
Echinococcus granulosus peregrin 0.0035 0.0062 0.0234
Brugia malayi MH1 domain containing protein 0.0042 0.0178 0.0178
Loa Loa (eye worm) hypothetical protein 0.0175 0.2459 0.2459
Echinococcus granulosus jumonji domain containing protein 0.0049 0.0298 0.1118
Echinococcus granulosus TGF beta signal transducer SmadC 0.0042 0.0178 0.0667
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0055 0.0405 0.0405
Brugia malayi RNA binding protein 0.0188 0.2669 0.2669
Plasmodium vivax hypothetical protein, conserved 0.0034 0.0044 0.0211
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0068 0.0628 0.2351
Toxoplasma gondii LsmAD domain-containing protein 0.0152 0.2063 1
Echinococcus granulosus GPCR family 2 0.008 0.0828 0.3101
Schistosoma mansoni sodium/chloride dependent transporter 0.0175 0.2459 0.9212
Echinococcus granulosus sodium and chloride dependent glycine 0.0175 0.2459 0.9212
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0034 0.0044 0.0163
Mycobacterium tuberculosis Probable aminotransferase 0.0149 0.2005 1
Brugia malayi MH2 domain containing protein 0.0042 0.0178 0.0178
Brugia malayi Sodium:neurotransmitter symporter family protein 1, putative 0.0034 0.0044 0.0044
Brugia malayi hypothetical protein 0.0098 0.1141 0.1141
Schistosoma mansoni smad 0.0042 0.0178 0.0667
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0034 0.0044 0.0163
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0034 0.0044 0.0044
Brugia malayi Smad1 0.0042 0.0178 0.0178
Loa Loa (eye worm) latrophilin receptor protein 2 0.008 0.0828 0.0828
Loa Loa (eye worm) hypothetical protein 0.006 0.0493 0.0493
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.008 0.0828 0.3101
Echinococcus multilocularis PHD finger protein rhinoceros 0.0035 0.0062 0.0234
Plasmodium vivax hypothetical protein, conserved 0.0035 0.0062 0.0302
Onchocerca volvulus Alhambra homolog 0.0035 0.0062 1
Loa Loa (eye worm) hypothetical protein 0.0034 0.0044 0.0044
Echinococcus multilocularis sodium and chloride dependent glycine 0.0175 0.2459 0.9212
Schistosoma mansoni jumonji/arid domain-containing protein 0.0043 0.0189 0.0709
Loa Loa (eye worm) hypothetical protein 0.0034 0.0044 0.0044
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0068 0.0628 0.2351
Echinococcus multilocularis inositol monophosphatase 1 0.0045 0.0223 0.0836
Loa Loa (eye worm) hypothetical protein 0.0152 0.2063 0.2063
Toxoplasma gondii hypothetical protein 0.0034 0.0044 0.0211
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0042 0.0178 0.0667
Echinococcus multilocularis mothers against decapentaplegic 5 0.0042 0.0178 0.0667
Giardia lamblia PHD finger protein 15 0.0035 0.0062 0.5
Loa Loa (eye worm) PHD-finger family protein 0.0035 0.0062 0.0062
Loa Loa (eye worm) MH2 domain-containing protein 0.0042 0.0178 0.0178
Brugia malayi MH2 domain containing protein 0.0042 0.0178 0.0178
Mycobacterium ulcerans hypothetical protein 0.0149 0.2005 1
Loa Loa (eye worm) hypothetical protein 0.0034 0.0044 0.0044
Trypanosoma brucei PAB1-binding protein , putative 0.0152 0.2063 1
Schistosoma mansoni tar DNA-binding protein 0.0188 0.2669 1
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0042 0.0178 0.0667
Loa Loa (eye worm) transcription factor SMAD2 0.0616 1 1
Echinococcus granulosus mothers against decapentaplegic 5 0.0042 0.0178 0.0667
Schistosoma mansoni sodium/chloride dependent transporter 0.0175 0.2459 0.9212
Toxoplasma gondii PHD-finger domain-containing protein 0.0035 0.0062 0.0302
Schistosoma mansoni hypothetical protein 0.0173 0.2415 0.9048
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0034 0.0044 0.0163
Brugia malayi hypothetical protein 0.0152 0.2063 0.2063
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0034 0.0044 0.0211
Schistosoma mansoni smad1 5 8 and 0.0042 0.0178 0.0667
Echinococcus multilocularis smad 0.0042 0.0178 0.0667
Echinococcus granulosus sodium dependent neurotransmitter transporter 0.0034 0.0044 0.0163
Brugia malayi jmjC domain containing protein 0.0043 0.0189 0.0189
Schistosoma mansoni inositol monophosphatase 0.0045 0.0223 0.0836
Loa Loa (eye worm) MH1 domain-containing protein 0.0042 0.0178 0.0178
Brugia malayi latrophilin 2 splice variant baaae 0.0173 0.2415 0.2415
Echinococcus granulosus uncharacterized sodium dependent transporter 0.0034 0.0044 0.0163
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0034 0.0044 0.0163
Echinococcus granulosus sodium and chloride dependent glycine 0.0175 0.2459 0.9212
Brugia malayi RNA recognition motif domain containing protein 0.0188 0.2669 0.2669
Schistosoma mansoni Smad4 0.0042 0.0178 0.0667
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0034 0.0044 0.0163
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0405 0.1518
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0175 0.2459 0.2459
Echinococcus multilocularis sodium and chloride dependent glycine 0.0175 0.2459 0.9212
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0034 0.0044 0.0163
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0115 0.1433 0.5368
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.008 0.0828 0.3101
Loa Loa (eye worm) inositol-1 0.0045 0.0223 0.0223
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0405 0.1518
Loa Loa (eye worm) hypothetical protein 0.0253 0.3783 0.3783
Echinococcus granulosus PHD finger protein rhinoceros 0.0035 0.0062 0.0234
Loa Loa (eye worm) hypothetical protein 0.0034 0.0044 0.0044
Brugia malayi hypothetical protein 0.0034 0.0044 0.0044
Echinococcus granulosus tar DNA binding protein 0.0188 0.2669 1
Schistosoma mansoni tar DNA-binding protein 0.0188 0.2669 1
Plasmodium falciparum amino acid transporter, putative 0.0034 0.0044 0.0211
Echinococcus granulosus uncharacterized sodium dependent transporter 0.0034 0.0044 0.0163
Loa Loa (eye worm) hypothetical protein 0.0034 0.0044 0.0044
Schistosoma mansoni sodium-dependent amino acid transporter 0.0034 0.0044 0.0163
Leishmania major hypothetical protein, conserved 0.0152 0.2063 1
Loa Loa (eye worm) norepinephrine transporter 0.0034 0.0044 0.0044
Schistosoma mansoni hypothetical protein 0.0068 0.0628 0.2351
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0253 0.3783 0.3783
Schistosoma mansoni sodium/chloride dependent transporter 0.0034 0.0044 0.0163
Echinococcus multilocularis peregrin 0.0035 0.0062 0.0234
Loa Loa (eye worm) serotonin transporter b 0.0034 0.0044 0.0044
Loa Loa (eye worm) jmjC domain-containing protein 0.0073 0.0704 0.0704
Chlamydia trachomatis Ssodium-dependent amino acid transporter 0.0034 0.0044 0.5
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0034 0.0044 0.0163
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0045 0.0223 0.1082
Schistosoma mansoni smad1 5 8 and 0.0042 0.0178 0.0667
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.008 0.0828 0.3101
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.0405 0.1518
Echinococcus multilocularis Smad4 0.0042 0.0178 0.0667
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0253 0.3783 0.3783
Plasmodium falciparum ataxin-2 like protein, putative 0.0152 0.2063 1
Echinococcus multilocularis tar DNA binding protein 0.0188 0.2669 1
Plasmodium falciparum ataxin-2 like protein, putative 0.0152 0.2063 1
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB 0.004 0.0143 0.0714
Loa Loa (eye worm) RNA binding protein 0.0188 0.2669 0.2669
Treponema pallidum sodium- and chloride- dependent transporter 0.0034 0.0044 0.5
Trypanosoma cruzi PAB1-binding protein , putative 0.0152 0.2063 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.0062 0.0062
Loa Loa (eye worm) Smad1 0.0042 0.0178 0.0178
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0034 0.0044 0.0211
Toxoplasma gondii PHD-finger domain-containing protein 0.0035 0.0062 0.0302
Loa Loa (eye worm) Sodium:neurotransmitter symporter family protein 0.0175 0.2459 0.2459
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0055 0.0405 0.0405
Loa Loa (eye worm) hypothetical protein 0.008 0.0828 0.0828
Echinococcus multilocularis jumonji domain containing protein 0.0049 0.0298 0.1118
Echinococcus multilocularis GPCR, family 2 0.008 0.0828 0.3101
Brugia malayi Bromodomain containing protein 0.0035 0.0062 0.0062

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.7943 uM PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 1.6511 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) = 5.0119 um PUBCHEM_BIOASSAY: qHTS Assay for Identifying the Cell-Membrane Permeable IMPase Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 15.8489 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of JMJD2A-Tudor Domain. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504402] ChEMBL. No reference
Potency (functional) = 56.2341 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Bacillus subtilis Sfp phosphopantetheinyl transferase (PPTase). (Class of assay: confirmatory) ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23

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

No literature references available for this target.

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