Detailed information for compound 1222223

Basic information

Technical information
  • TDR Targets ID: 1222223
  • Name: 1-[4-(2-hydroxyethyl)piperazin-1-yl]-3-naphth alen-2-yloxypropan-2-ol hydrochloride
  • MW: 366.882 | Formula: C19H27ClN2O3
  • H donors: 2 H acceptors: 2 LogP: 2.49 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: OCCN1CCN(CC1)CC(COc1ccc2c(c1)cccc2)O.Cl
  • InChi: 1S/C19H26N2O3.ClH/c22-12-11-20-7-9-21(10-8-20)14-18(23)15-24-19-6-5-16-3-1-2-4-17(16)13-19;/h1-6,13,18,22-23H,7-12,14-15H2;1H
  • InChiKey: FAMLEIAJYSCJFA-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 1-[4-(2-hydroxyethyl)piperazin-1-yl]-3-(2-naphthyloxy)propan-2-ol hydrochloride
  • 1-[4-(2-hydroxyethyl)-1-piperazinyl]-3-(2-naphthyloxy)propan-2-ol hydrochloride
  • 1-[4-(2-hydroxyethyl)piperazin-1-yl]-3-naphthalen-2-yloxy-propan-2-ol hydrochloride
  • SMR000061491
  • MLS000054080

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Human immunodeficiency virus 1 Aberrant vpr protein Starlite/ChEMBL No references
Homo sapiens bromodomain adjacent to zinc finger domain, 2B Starlite/ChEMBL No references
Homo sapiens apolipoprotein B mRNA editing enzyme, catalytic polypeptide-like 3D Starlite/ChEMBL No references
Homo sapiens euchromatic histone-lysine N-methyltransferase 2 Starlite/ChEMBL No references
Homo sapiens Werner syndrome, RecQ helicase-like Starlite/ChEMBL No references
Bacillus subtilis 4'-phosphopantetheinyl transferase ffp Starlite/ChEMBL No references
Homo sapiens glucagon-like peptide 1 receptor Starlite/ChEMBL No references
Homo sapiens GNAS complex locus Starlite/ChEMBL No references
Homo sapiens geminin, DNA replication inhibitor Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Brugia malayi ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Loa Loa (eye worm) ATP-dependent DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma japonicum ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative Get druggable targets OG5_131088 All targets in OG5_131088
Theileria parva DNA helicase, putative Get druggable targets OG5_126644 All targets in OG5_126644
Trichomonas vaginalis set domain proteins, putative Get druggable targets OG5_131470 All targets in OG5_131470
Echinococcus multilocularis ATP dependent DNA helicase Q5 Get druggable targets OG5_126644 All targets in OG5_126644
Cryptosporidium hominis DEAD/DEAH box helicase Get druggable targets OG5_126644 All targets in OG5_126644
Onchocerca volvulus Get druggable targets OG5_131470 All targets in OG5_131470
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma japonicum ko:K01549 ATP synthase [EC3.6.3.14], putative Get druggable targets OG5_131570 All targets in OG5_131570
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Onchocerca volvulus Get druggable targets OG5_129301 All targets in OG5_129301
Neospora caninum hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
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 infantum ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Entamoeba histolytica recQ family helicase, putative Get druggable targets OG5_126644 All targets in OG5_126644
Cryptosporidium parvum RecQ bloom helicase (RNA helicase+hrdc) Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma mansoni DNA helicase recq5 Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma mansoni aminoadipate-semialdehyde dehydrogenase Get druggable targets OG5_129301 All targets in OG5_129301
Plasmodium knowlesi ADP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
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
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Brugia malayi Pre-SET motif family protein Get druggable targets OG5_131470 All targets in OG5_131470
Brugia malayi ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma japonicum expressed protein Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma mansoni blooms syndrome DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania mexicana ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma mansoni bromodomain containing protein Get druggable targets OG5_131570 All targets in OG5_131570
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
Giardia lamblia Sgs1 DNA helicase, putative Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Candida albicans DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma japonicum Bloom syndrome protein homolog, putative Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania braziliensis ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma japonicum hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Plasmodium falciparum ATP-dependent DNA helicase Q1 Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma japonicum ko:K03654 ATP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Candida albicans DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus granulosus L aminoadipate semialdehyde Get druggable targets OG5_129301 All targets in OG5_129301
Schistosoma japonicum Conserved hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma japonicum Cleft lip and palate transmembrane protein 1-like protein, putative Get druggable targets OG5_131570 All targets in OG5_131570
Plasmodium falciparum ADP-dependent DNA helicase RecQ Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus granulosus bromodomain adjacent to zinc finger domain Get druggable targets OG5_131570 All targets in OG5_131570
Plasmodium berghei ATP-dependent DNA helicase Q1, putative Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma mansoni DNA helicase recq1 Get druggable targets OG5_126644 All targets in OG5_126644
Theileria parva hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_129301 All targets in OG5_129301
Cryptosporidium hominis proteinx0005 Get druggable targets OG5_129301 All targets in OG5_129301
Leishmania donovani ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus multilocularis bloom syndrome protein Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus multilocularis ATP dependent DNA helicase Q1 Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus granulosus bloom syndrome protein Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium yoelii ATP-dependent DNA helicase-related Get druggable targets OG5_126644 All targets in OG5_126644
Babesia bovis ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma japonicum expressed protein Get druggable targets OG5_129301 All targets in OG5_129301
Echinococcus multilocularis bromodomain adjacent to zinc finger domain Get druggable targets OG5_131570 All targets in OG5_131570
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Entamoeba histolytica recQ family DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Neospora caninum hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative Get druggable targets OG5_131088 All targets in OG5_131088
Loa Loa (eye worm) pre-SET domain-containing protein family protein Get druggable targets OG5_131470 All targets in OG5_131470
Trichomonas vaginalis DNA helicase recq, putative Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus granulosus ATP dependent DNA helicase Q5 Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus multilocularis L aminoadipate semialdehyde Get druggable targets OG5_129301 All targets in OG5_129301
Schistosoma japonicum ko:K00142 aminoadipate-semialdehyde dehydrogenase [EC1.2.1.31], putative Get druggable targets OG5_129301 All targets in OG5_129301
Brugia malayi Bromodomain containing protein Get druggable targets OG5_131570 All targets in OG5_131570
Babesia bovis ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Trichomonas vaginalis DNA helicase recq, putative Get druggable targets OG5_126644 All targets in OG5_126644
Brugia malayi Bloom's syndrome protein homolog Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium berghei ADP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Trichomonas vaginalis DNA helicase recq1, putative Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Brugia malayi aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase Get druggable targets OG5_129301 All targets in OG5_129301
Cryptosporidium parvum phosphopantetheinyl transferase Get druggable targets OG5_129301 All targets in OG5_129301
Trypanosoma brucei gambiense ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium yoelii ATP-dependent DNA helicase recQ-related Get druggable targets OG5_126644 All targets in OG5_126644
Treponema pallidum ATP-dependent DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) RecQ helicase Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium knowlesi ATP-dependent DNA helicase Q1, putative Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus granulosus ATP dependent DNA helicase Q1 Get druggable targets OG5_126644 All targets in OG5_126644
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi Hypothetical 65.5 kDa Trp-Asp repeats containing protein F02E8.5 inchromosome X geminin, DNA replication inhibitor 209 aa 176 aa 27.8 %
Entamoeba histolytica hypothetical protein 4'-phosphopantetheinyl transferase ffp   224 aa 198 aa 28.3 %
Trichomonas vaginalis conserved hypothetical protein 4'-phosphopantetheinyl transferase ffp   224 aa 197 aa 22.3 %
Schistosoma mansoni GTP-binding protein alpha subunit gna GNAS complex locus 394 aa 450 aa 28.7 %
Onchocerca volvulus 4'-phosphopantetheinyl transferase ffp   224 aa 186 aa 26.3 %
Candida albicans aminoadipate-semialdehyde dehydrogenase small subunit 4'-phosphopantetheinyl transferase ffp   224 aa 183 aa 27.3 %
Candida albicans aminoadipate-semialdehyde dehydrogenase small subunit 4'-phosphopantetheinyl transferase ffp   224 aa 183 aa 27.3 %
Loa Loa (eye worm) pigment dispersing factor receptor c glucagon-like peptide 1 receptor 463 aa 388 aa 25.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0019 0.0463 0.0368
Schistosoma mansoni aminoadipate-semialdehyde dehydrogenase 0.01 0.3369 0.475
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.1755 0.2246
Brugia malayi aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase 0.01 0.3369 0.3695
Trypanosoma cruzi ISWI complex protein 0.0018 0.0442 1
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.1933 0.2015
Schistosoma mansoni aldehyde dehydrogenase 0.006 0.191 0.2694
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.006 0.191 1
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0019 0.0474 0.2481
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0043 0.1332 0.1631
Loa Loa (eye worm) hypothetical protein 0.0085 0.2833 0.3068
Toxoplasma gondii 4'-phosphopantetheinyl transferase domain-containing protein 0.0028 0.0791 0.414
Loa Loa (eye worm) hypothetical protein 0.0046 0.1437 0.1436
Toxoplasma gondii 4'-phosphopantetheinyl transferase superfamily protein 0.0028 0.0791 0.414
Schistosoma mansoni hypothetical protein 0.0019 0.0463 0.0652
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.006 0.191 0.2471
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0072 0.2357 0.3121
Loa Loa (eye worm) bromodomain containing protein 0.0021 0.0544 0.0391
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0036 0.107 0.125
Loa Loa (eye worm) latrophilin receptor protein 2 0.0019 0.0463 0.0296
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.191 1
Brugia malayi Bloom's syndrome protein homolog 0.0029 0.0818 0.0711
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0036 0.107 0.56
Giardia lamblia Sgs1 DNA helicase, putative 0.0012 0.021 0.5
Brugia malayi Pre-SET motif family protein 0.0251 0.876 1
Echinococcus multilocularis zinc finger protein 0.0024 0.0627 0.0606
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.006 0.191 1
Schistosoma mansoni hypothetical protein 0.0019 0.0463 0.0652
Loa Loa (eye worm) hypothetical protein 0.0052 0.1622 0.1652
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0072 0.2357 0.3121
Loa Loa (eye worm) hypothetical protein 0.0057 0.1805 0.1866
Echinococcus granulosus geminin 0.0205 0.7092 1
Loa Loa (eye worm) PHD-finger family protein 0.0025 0.0672 0.0541
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0027 0.0755 0.0792
Schistosoma mansoni blooms syndrome DNA helicase 0.0023 0.06 0.0846
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0027 0.0755 0.1064
Schistosoma mansoni hypothetical protein 0.0018 0.0442 0.0623
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0251 0.876 1
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0043 0.1332 0.1631
Trypanosoma cruzi ISWI complex protein 0.0018 0.0442 1
Schistosoma mansoni methyl-cpg binding protein mbd 0.0021 0.0518 0.073
Schistosoma mansoni hypothetical protein 0.0205 0.7092 1
Trichomonas vaginalis set domain proteins, putative 0.0286 1 1
Schistosoma mansoni hypothetical protein 0.0041 0.1252 0.1766
Entamoeba histolytica recQ family helicase, putative 0.0015 0.0335 0.424
Echinococcus granulosus histone lysine methyltransferase setb 0.0057 0.1805 0.2319
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.1755 0.2475
Echinococcus granulosus zinc finger protein 0.0024 0.0627 0.0606
Schistosoma mansoni bromodomain containing protein 0.0076 0.2512 0.3542
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0019 0.0463 0.0368
Echinococcus multilocularis L aminoadipate semialdehyde 0.01 0.3369 0.459
Loa Loa (eye worm) hypothetical protein 0.0182 0.63 0.7124
Schistosoma mansoni zinc finger protein 0.0024 0.0627 0.0884
Brugia malayi Latrophilin receptor protein 2 0.0019 0.0463 0.0296
Schistosoma mansoni hypothetical protein 0.0025 0.0672 0.0948
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0057 0.1805 0.2546
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0055 0.1755 0.1808
Brugia malayi Pre-SET motif family protein 0.0036 0.107 0.1006
Echinococcus granulosus fetal alzheimer antigen falz 0.0027 0.0755 0.0792
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0019 0.0463 0.0296
Schistosoma mansoni hypothetical protein 0.0019 0.0463 0.0652
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.006 0.191 0.2471
Onchocerca volvulus 0.01 0.3369 0.2574
Treponema pallidum 4'-phosphopantetheinyl transferase 0.0028 0.0791 0.5
Loa Loa (eye worm) hypothetical protein 0.0049 0.1539 0.1555
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.1755 0.2246
Schistosoma mansoni zinc finger protein 0.0018 0.0442 0.0623
Brugia malayi Bromodomain containing protein 0.0046 0.1434 0.1432
Trypanosoma brucei ISWI complex protein 0.0018 0.0442 0.2343
Echinococcus granulosus methyl CpG binding domain protein 2 0.0021 0.0518 0.0448
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0036 0.107 0.1509
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.1755 0.2246
Mycobacterium leprae conserved hypothetical protein 0.0028 0.0791 0.5
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0057 0.1805 0.2319
Schistosoma mansoni DNA helicase recq1 0.0012 0.021 0.0296
Schistosoma mansoni hypothetical protein 0.0205 0.7092 1
Echinococcus granulosus GPCR family 2 0.0019 0.0463 0.0368
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0025 0.0692 0.8298
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0012 0.021 0.1097
Schistosoma mansoni aldehyde dehydrogenase 0.006 0.191 0.2694
Echinococcus multilocularis GPCR, family 2 0.0019 0.0463 0.0368
Plasmodium vivax holo-[acyl-carrier-protein] synthase, putative 0.0028 0.0791 0.5251
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0035 0.1022 0.1181
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.191 1
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0021 0.0518 0.0448
Loa Loa (eye worm) hypothetical protein 0.01 0.3369 0.3695
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0019 0.0463 0.0368
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.1755 0.2475
Loa Loa (eye worm) hypothetical protein 0.006 0.1933 0.2015
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.107 0.1509
Trypanosoma brucei hypothetical protein, conserved 0.0028 0.0791 1
Chlamydia trachomatis holo [acyl-carrier protein] synthase 0.0028 0.0791 0.5
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0057 0.1805 0.2546
Echinococcus multilocularis bloom syndrome protein 0.0029 0.0818 0.0884
Loa Loa (eye worm) hypothetical protein 0.0019 0.0463 0.0296
Trichomonas vaginalis DNA helicase recq, putative 0.0029 0.0818 0.0499
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.1933 0.2015
Leishmania major hypothetical protein, conserved 0.0018 0.0442 0.0678
Wolbachia endosymbiont of Brugia malayi 4'-phosphopantetheinyl transferase 0.0028 0.0791 0.5
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.1933 0.2015
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0012 0.021 0.1097
Plasmodium falciparum holo-[acyl-carrier-protein] synthase, putative 0.0028 0.0791 1
Loa Loa (eye worm) hypothetical protein 0.0041 0.1252 0.1219
Brugia malayi Bromodomain containing protein 0.0091 0.3017 0.3284
Echinococcus multilocularis geminin 0.0205 0.7092 1
Leishmania major phosphopantetheinyl transferase-like protein 0.0028 0.0791 0.2892
Entamoeba histolytica hypothetical protein 0.0028 0.0791 1
Brugia malayi hypothetical protein 0.0182 0.63 0.7124
Onchocerca volvulus 0.0182 0.63 0.5857
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0055 0.1755 0.1808
Echinococcus granulosus bloom syndrome protein 0.0029 0.0818 0.0884
Trichomonas vaginalis DNA helicase recq1, putative 0.0029 0.0818 0.0499
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.1755 0.2475
Echinococcus granulosus L aminoadipate semialdehyde 0.01 0.3369 0.459
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0019 0.0463 0.0368
Toxoplasma gondii aldehyde dehydrogenase 0.006 0.191 1
Schistosoma mansoni methyl-cpg binding protein mbd 0.0021 0.0518 0.073
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.191 1
Schistosoma mansoni hypothetical protein 0.0019 0.0463 0.0652
Loa Loa (eye worm) hypothetical protein 0.0146 0.4995 0.5596
Loa Loa (eye worm) RecQ helicase 0.0029 0.0818 0.0711
Brugia malayi PHD-finger family protein 0.003 0.0857 0.0757
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.1755 0.2246
Schistosoma mansoni DNA helicase recq5 0.0012 0.021 0.0296
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.1252 0.1219
Plasmodium vivax SET domain protein, putative 0.0036 0.107 1

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.2909 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in MCF 10a normal breast cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 0.631 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of binding or entry into cells for Lassa Virus. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID463114, AID540249] ChEMBL. No reference
Potency (functional) 1.2589 uM PubChem BioAssay. qHTS Assay for Inhibitors of the HIV-1 protein Vpr. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 1.4125 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] ChEMBL. No reference
Potency (functional) 1.4125 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] ChEMBL. No reference
Potency (functional) 1.4125 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Vif-A3F Interactions: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 3.1623 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Bacillus subtilis Sfp phosphopantetheinyl transferase (PPTase). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 3.5481 uM PubChem BioAssay. qHTS for Inhibitors of WRN Helicase. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 8.9125 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 12.5893 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) 29.0929 uM PubChem BioAssay. qHTS for induction of synthetic lethality in tumor cells producing 2HG: qHTS for the HT-1080-NT fibrosarcoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 31.6228 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human Jumonji Domain Containing 2E (JMJD2E). (Class of assay: confirmatory) ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens 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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