Detailed information for compound 1406225

Basic information

Technical information
  • TDR Targets ID: 1406225
  • Name: 1-(3-bromophenyl)-2-piperidin-1-ylethanone hy drobromide
  • MW: 363.088 | Formula: C13H17Br2NO
  • H donors: 0 H acceptors: 1 LogP: 4.18 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: Brc1cccc(c1)C(=O)CN1CCCCC1.Br
  • InChi: 1S/C13H16BrNO.BrH/c14-12-6-4-5-11(9-12)13(16)10-15-7-2-1-3-8-15;/h4-6,9H,1-3,7-8,10H2;1H
  • InChiKey: HCEJNHONALFMRK-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 1-(3-bromophenyl)-2-(1-piperidyl)ethanone hydrobromide
  • 1-(3-bromophenyl)-2-piperidino-ethanone hydrobromide
  • 1-(3-bromophenyl)-2-piperidin-1-yl-ethanone hydrobromide
  • SMR000261594
  • T0512-1147
  • MLS000392671

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens karyopherin (importin) beta 1 No references
Homo sapiens GNAS complex locus Starlite/ChEMBL No references
Homo sapiens snurportin 1 No references
Homo sapiens aldehyde dehydrogenase 1 family, member A1 Starlite/ChEMBL No references
Homo sapiens euchromatic histone-lysine N-methyltransferase 2 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Trichomonas vaginalis Importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma mansoni aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma mansoni hypothetical protein Get druggable targets OG5_131808 All targets in OG5_131808
Leishmania infantum importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Candida albicans Mitochondrial aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Plasmodium yoelii importin beta-1 subunit Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania mexicana importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Brugia malayi RNA, U transporter 1 Get druggable targets OG5_131808 All targets in OG5_131808
Onchocerca volvulus Get druggable targets OG5_131470 All targets in OG5_131470
Candida albicans karyopherin-beta Get druggable targets OG5_127843 All targets in OG5_127843
Trichomonas vaginalis set domain proteins, putative Get druggable targets OG5_131470 All targets in OG5_131470
Toxoplasma gondii aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Neospora caninum hypothetical protein Get druggable targets OG5_126638 All targets in OG5_126638
Trypanosoma congolense importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
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 donovani importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Neospora caninum hypothetical protein Get druggable targets OG5_127843 All targets in OG5_127843
Babesia bovis importin beta subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Loa Loa (eye worm) nucleolar RNA-associated protein alpha Get druggable targets OG5_131808 All targets in OG5_131808
Schistosoma japonicum ko:K00128 aldehyde dehydrogenase (NAD+) [EC1.2.1.3], putative Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative 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
Plasmodium knowlesi importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Loa Loa (eye worm) pre-SET domain-containing protein family protein Get druggable targets OG5_131470 All targets in OG5_131470
Schistosoma mansoni aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Mycobacterium tuberculosis Probable aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania major importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial Get druggable targets OG5_126638 All targets in OG5_126638
Trypanosoma cruzi importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus granulosus importin subunit beta 1 Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania major aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Theileria parva importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium falciparum importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus granulosus aldehyde dehydrogenase mitochondrial Get druggable targets OG5_126638 All targets in OG5_126638
Brugia malayi Importin beta-1 subunit Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma japonicum Aldehyde dehydrogenase X, mitochondrial precursor, putative Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma japonicum Aldehyde dehydrogenase, mitochondrial precursor, putative Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum Snurportin-1, putative Get druggable targets OG5_131808 All targets in OG5_131808
Plasmodium vivax importin-beta 2, putative Get druggable targets OG5_127843 All targets in OG5_127843
Candida albicans karyopherin-beta Get druggable targets OG5_127843 All targets in OG5_127843
Trypanosoma brucei importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma japonicum Importin subunit beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania braziliensis aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Candida albicans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania donovani aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Candida albicans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Trypanosoma brucei gambiense importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus multilocularis snurportin 1 Get druggable targets OG5_131808 All targets in OG5_131808
Schistosoma japonicum Retinal dehydrogenase 1, putative Get druggable targets OG5_126638 All targets in OG5_126638
Trichomonas vaginalis Importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
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
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127843 All targets in OG5_127843
Brugia malayi Pre-SET motif family protein Get druggable targets OG5_131470 All targets in OG5_131470
Candida albicans Mitochondrial aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Trypanosoma brucei importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Trichomonas vaginalis importin beta-1, putative Get druggable targets OG5_127843 All targets in OG5_127843
Toxoplasma gondii HEAT repeat-containing protein Get druggable targets OG5_127843 All targets in OG5_127843
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus multilocularis importin subunit beta 1 Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus granulosus snurportin 1 Get druggable targets OG5_131808 All targets in OG5_131808
Cryptosporidium parvum importin/karyopherin Get druggable targets OG5_127843 All targets in OG5_127843
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
Schistosoma japonicum Importin subunit beta-1, putative Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma mansoni importin beta-1 Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania infantum aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Plasmodium berghei importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania mexicana aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Cryptosporidium hominis importin-beta2 Get druggable targets OG5_127843 All targets in OG5_127843
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) GTP-binding regulatory protein Gs alpha-S chain 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
Entamoeba histolytica hypothetical protein Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania braziliensis importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Mycobacterium tuberculosis Succinate-semialdehyde dehydrogenase [NADP+] dependent (SSDH) GabD1 aldehyde dehydrogenase 1 family, member A1 501 aa 456 aa 33.3 %
Schistosoma mansoni GTP-binding protein alpha subunit gna GNAS complex locus 394 aa 450 aa 28.7 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0036 0.0039 0.0088
Schistosoma mansoni voltage-gated cation channel 0.0174 0.414 0.4139
Loa Loa (eye worm) ryanodine receptor 0.0174 0.414 0.4139
Echinococcus granulosus shaker cognate 0.0174 0.414 0.414
Leishmania major hypothetical protein, unknown function 0.0174 0.414 1
Loa Loa (eye worm) hypothetical protein 0.0174 0.414 0.4139
Brugia malayi cation channel family protein 0.0174 0.414 0.644
Schistosoma mansoni two-pore calcium channel 0.0174 0.414 0.4139
Echinococcus granulosus potassium voltage gated channel protein 0.0174 0.414 0.414
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0073 0.1145 0.1145
Loa Loa (eye worm) hypothetical protein 0.0174 0.414 0.4139
Echinococcus multilocularis potassium large conductance calcium activated 0.0174 0.414 0.4139
Echinococcus granulosus potassium large conductance calcium activated 0.0174 0.414 0.414
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.0039 0.0036
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.0609 0.0609
Loa Loa (eye worm) hypothetical protein 0.0174 0.414 0.4139
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.0039 0.0036
Echinococcus multilocularis voltage dependent calcium channel 0.0174 0.414 0.4139
Echinococcus granulosus importin subunit beta 1 0.0035 0.0003 0.0003
Schistosoma mansoni voltage-gated potassium channel 0.0174 0.414 0.4139
Echinococcus granulosus cyclic nucleotide gated cation channel 0.0174 0.414 0.414
Onchocerca volvulus 0.0286 0.7458 1
Echinococcus multilocularis calcium activated potassium channel 0.0174 0.414 0.4139
Plasmodium vivax SET domain protein, putative 0.0036 0.0039 1
Schistosoma mansoni transient receptor potential cation channel subfamily m member 0.0174 0.414 0.4139
Echinococcus multilocularis potassium voltage gated channel subfamily D 0.0174 0.414 0.4139
Brugia malayi Voltage-gated potassium channel, Shaker-family (KCNA, Kv1-like) alpha-subunit 0.0174 0.414 0.644
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0174 0.414 0.414
Echinococcus multilocularis hyperpolarization activated cyclic 0.0174 0.414 0.4139
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.0609 0.0609
Schistosoma mansoni high voltage-activated calcium channel Cav1 0.0174 0.414 0.4139
Echinococcus granulosus potassium channel KvQLT family member kqt 1 0.0174 0.414 0.414
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.0174 0.414 0.4139
Echinococcus multilocularis potassium voltage gated channel protein 0.0174 0.414 0.4139
Loa Loa (eye worm) hypothetical protein 0.0174 0.414 0.4139
Schistosoma mansoni voltage-gated potassium channel 0.0174 0.414 0.4139
Loa Loa (eye worm) hypothetical protein 0.0174 0.414 0.4139
Schistosoma mansoni voltage-gated potassium channel 0.0174 0.414 0.4139
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0055 0.0609 0.0606
Echinococcus multilocularis transfer RNA-Gly 0.0174 0.414 0.4139
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0073 0.1145 0.1143
Echinococcus multilocularis transient receptor potential cation channel 0.0174 0.414 0.4139
Echinococcus granulosus two pore calcium channel protein 1 0.0174 0.414 0.414
Echinococcus multilocularis cyclic nucleotide gated cation channel alpha 3 0.0174 0.414 0.4139
Echinococcus granulosus transient receptor potential cation channel 0.0174 0.414 0.414
Echinococcus multilocularis short transient receptor potential channel 6 0.0174 0.414 0.4139
Schistosoma mansoni hypothetical protein 0.0174 0.414 0.4139
Schistosoma mansoni voltage-gated potassium channel 0.0174 0.414 0.4139
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0036 0.0039 0.0036
Schistosoma mansoni voltage-gated potassium channel 0.0174 0.414 0.4139
Brugia malayi Ryanodine Receptor TM 4-6 family protein 0.0174 0.414 0.644
Echinococcus multilocularis voltage dependent L type calcium channel subunit 0.0174 0.414 0.4139
Brugia malayi Voltage-gated potassium channel, Shaw-family (KCNC, Kv3-like) alpha-subunit 0.0174 0.414 0.644
Echinococcus granulosus voltage dependent calcium channel 0.0174 0.414 0.414
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0609 0.0606
Echinococcus multilocularis transient receptor potential cation channel 0.0174 0.414 0.4139
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0174 0.414 1
Schistosoma mansoni transient receptor potential cation channel subfamily m member 0.0174 0.414 0.4139
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0174 0.414 1
Schistosoma mansoni voltage-gated potassium channel 0.0174 0.414 0.4139
Loa Loa (eye worm) hypothetical protein 0.0174 0.414 0.4139
Echinococcus multilocularis transient receptor potential gamma protein 0.0174 0.414 0.4139
Onchocerca volvulus Transient receptor potential cation channel trpm homolog 0.0174 0.414 0.5528
Echinococcus multilocularis voltage dependent calcium channel 0.0174 0.414 0.4139
Echinococcus granulosus potassium voltage gated channel protein 0.0174 0.414 0.414
Toxoplasma gondii transporter, cation channel family protein 0.0174 0.414 1
Schistosoma mansoni transient receptor potential cation channel subfamily m member 0.0174 0.414 0.4139
Echinococcus multilocularis ryanodine receptor 44f 0.0174 0.414 0.4139
Brugia malayi RNA, U transporter 1 0.0099 0.1908 0.2965
Echinococcus multilocularis potassium:sodium hyperpolarization activated 0.0174 0.414 0.4139
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.0609 0.0606
Schistosoma mansoni transient receptor potential cation channel subfamily m member 0.0174 0.414 0.4139
Loa Loa (eye worm) hypothetical protein 0.0174 0.414 0.4139
Echinococcus granulosus cyclic nucleotide gated cation channel 0.0174 0.414 0.414
Loa Loa (eye worm) voltage-dependent calcium channel 0.0174 0.414 0.4139
Schistosoma mansoni voltage-gated potassium channel 0.0174 0.414 0.4139
Loa Loa (eye worm) hypothetical protein 0.0174 0.414 0.4139
Echinococcus granulosus ryanodine receptor 44f 0.0174 0.414 0.414
Trypanosoma brucei Voltage-dependent calcium channel subunit, putative 0.0174 0.414 1
Toxoplasma gondii hypothetical protein 0.0174 0.414 1
Echinococcus granulosus TRP transient receptor potential channel 0.0174 0.414 0.414
Echinococcus multilocularis transient receptor potential cation channel 0.0174 0.414 0.4139
Brugia malayi Pre-SET motif family protein 0.0251 0.6427 1
Brugia malayi Voltage-gated calcium channel, T-type, alpha subunit. C. elegans cca-1 ortholog 0.0174 0.414 0.644
Brugia malayi voltage-dependent calcium channel 0.0174 0.414 0.644
Echinococcus multilocularis transient receptor potential cation channel 0.0174 0.414 0.4139
Leishmania major hypothetical protein, conserved 0.0174 0.414 1
Schistosoma mansoni voltage-gated potassium channel KCNQ 0.0174 0.414 0.4139
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.0039 0.0036
Brugia malayi Voltage-gated calcium channel, alpha subunit 0.0174 0.414 0.644
Echinococcus multilocularis potassium voltage gated channel subfamily A 0.0174 0.414 0.4139
Echinococcus multilocularis hyperpolarization activated cyclic 0.0174 0.414 0.4139
Echinococcus granulosus sodium channel protein 0.0174 0.414 0.414
Echinococcus granulosus potassium voltage gated channel subfamily A 0.0174 0.414 0.414
Brugia malayi Voltage-gated calcium channel, P/Q-type, alpha subunit. C. elegans unc-2 ortholog 0.0174 0.414 0.644
Schistosoma mansoni transient receptor potential channel 0.0174 0.414 0.4139
Brugia malayi Voltage-gated potassium channel, Shab-family (KCNB, Kv2-like) alpha-subunit. C. elegans exp-2 ortholog 0.0174 0.414 0.644
Schistosoma mansoni voltage-gated potassium channel 0.0174 0.414 0.4139
Echinococcus granulosus potassium voltage gated channel subfamily D 0.0174 0.414 0.414
Schistosoma mansoni inositol 145-trisphosphate receptor 0.0174 0.414 0.4139
Echinococcus granulosus voltage gated hydrogen channel 1 0.0174 0.414 0.414
Schistosoma mansoni transient receptor potential channel 0.0174 0.414 0.4139
Echinococcus granulosus cyclic nucleotide gated cation channel alpha 3 0.0174 0.414 0.414
Echinococcus granulosus transient receptor potential cation channel 0.0174 0.414 0.414
Echinococcus multilocularis potassium voltage gated channel protein 0.0174 0.414 0.4139
Loa Loa (eye worm) hypothetical protein 0.0036 0.0039 0.0036
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.1145 0.5
Echinococcus multilocularis cyclic nucleotide gated cation channel 0.0174 0.414 0.4139
Loa Loa (eye worm) hypothetical protein 0.0174 0.414 0.4139
Schistosoma mansoni calcium-activated potassium channel 0.0174 0.414 0.4139
Echinococcus granulosus Potassium voltage gated channel protein Shaw 0.0174 0.414 0.414
Toxoplasma gondii transporter, cation channel family protein 0.0174 0.414 1
Brugia malayi Voltage-gated potassium channel, KCNQ (Kv7-like) alpha-subunit. C. elegans kqt-1 ortholog 0.0174 0.414 0.644
Echinococcus granulosus potassium voltage gated channel subfamily D 0.0174 0.414 0.414
Loa Loa (eye worm) hypothetical protein 0.0174 0.414 0.4139
Loa Loa (eye worm) voltage-gated potassium channel 0.0174 0.414 0.4139
Echinococcus multilocularis potassium voltage gated channel subfamily KQT 0.0174 0.414 0.4139
Brugia malayi Large-conductance calcium-activated potassium channel Slo-1 (KCNMA) alpha subunit. C. elegans slo-1 ortholog 0.0174 0.414 0.644
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0609 0.0606
Echinococcus multilocularis potassium voltage gated channel protein 0.0174 0.414 0.4139
Echinococcus granulosus voltage dependent calcium channel 0.0174 0.414 0.414
Loa Loa (eye worm) hypothetical protein 0.0174 0.414 0.4139
Echinococcus granulosus potassium voltage gated channel protein 0.0174 0.414 0.414
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.1145 0.5
Loa Loa (eye worm) hypothetical protein 0.0174 0.414 0.4139
Trypanosoma brucei inositol 1,4,5-trisphosphate receptor 0.0174 0.414 1
Echinococcus granulosus voltage dependent calcium channel type d subunit|voltage dependent calcium channel|voltage dependent L type calcium channel subu 0.0174 0.414 0.414
Echinococcus granulosus transient receptor potential cation channel 0.0174 0.414 0.414
Brugia malayi cation channel family protein 0.0174 0.414 0.644
Brugia malayi Voltage-gated potassium channel, Shaw-family (KCNC, Kv3-like) alpha-subunit. C. elegans egl-36 ortholog 0.0174 0.414 0.644
Echinococcus granulosus hyperpolarization activated cyclic 0.0174 0.414 0.414
Brugia malayi Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog 0.0174 0.414 0.644
Loa Loa (eye worm) cyclic-nucleotide gated cation channel 0.0174 0.414 0.4139
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0174 0.414 0.4139
Echinococcus multilocularis voltage gated potassium channel 0.0174 0.414 0.4139
Echinococcus multilocularis two pore calcium channel protein 1 0.0174 0.414 0.4139
Brugia malayi olfactory channel protein osm-9 0.0174 0.414 0.644
Echinococcus multilocularis transient receptor potential cation channel 0.0174 0.414 0.4139
Plasmodium falciparum importin beta, putative 0.0035 0.0003 0.5
Echinococcus multilocularis short transient receptor potential channel 6 0.0174 0.414 0.4139
Brugia malayi Cyclic-nucleotide gated cation channel 0.0174 0.414 0.644
Echinococcus multilocularis potassium voltage gated channel subfamily D 0.0174 0.414 0.4139
Loa Loa (eye worm) voltage-gated potassium channel 0.0174 0.414 0.4139
Schistosoma mansoni ryanodine receptor related 0.0174 0.414 0.4139
Schistosoma mansoni voltage-gated ion channel 0.0174 0.414 0.4139
Schistosoma mansoni transient receptor potential channel 0.0174 0.414 0.4139
Schistosoma mansoni voltage-gated potassium channel 0.0174 0.414 0.4139
Loa Loa (eye worm) hypothetical protein 0.0174 0.414 0.4139
Schistosoma mansoni transient receptor potential cation channel subfamily m member 0.0174 0.414 0.4139
Schistosoma mansoni voltage-gated potassium channel 0.0174 0.414 0.4139
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0174 0.414 0.414
Schistosoma mansoni vesicular amine transporter 0.0174 0.414 0.4139
Echinococcus granulosus voltage dependent L type calcium channel subunit|voltage dependent calcium channel 0.0174 0.414 0.414
Echinococcus granulosus voltage gated sodium channel Nav1 alpha subunit 0.0174 0.414 0.414
Echinococcus multilocularis transient receptor potential cation channel 0.0174 0.414 0.4139
Loa Loa (eye worm) hypothetical protein 0.0174 0.414 0.4139
Brugia malayi hypothetical protein 0.0174 0.414 0.644
Echinococcus granulosus potassium voltage gated channel protein 0.0174 0.414 0.414
Schistosoma mansoni aldehyde dehydrogenase 0.0073 0.1145 0.1143
Loa Loa (eye worm) ion channel NompC 0.0174 0.414 0.4139
Onchocerca volvulus 0.0174 0.414 0.5528
Echinococcus granulosus voltage dependent calcium channel type d subunit|voltage dependent calcium channel alpha 1 0.0174 0.414 0.414
Brugia malayi Pre-SET motif family protein 0.0036 0.0039 0.0057
Toxoplasma gondii transporter, cation channel family protein 0.0174 0.414 1
Schistosoma mansoni calcium channel voltage-dependent p/q type alpha 1a-related 0.0174 0.414 0.4139
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0055 0.0609 0.0943
Echinococcus multilocularis TRP (transient receptor potential) channel 0.0174 0.414 0.4139
Schistosoma mansoni voltage-gated potassium channel 0.0174 0.414 0.4139
Loa Loa (eye worm) hypothetical protein 0.0174 0.414 0.4139
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0251 0.6427 0.6426
Echinococcus granulosus sodium leak channel non selective protein 0.0174 0.414 0.414
Toxoplasma gondii aldehyde dehydrogenase 0.0073 0.1145 0.2762
Echinococcus granulosus calcium activated potassium channel 0.0174 0.414 0.414
Echinococcus multilocularis voltage dependent L type calcium channel subunit 0.0174 0.414 0.4139
Loa Loa (eye worm) hypothetical protein 0.0174 0.414 0.4139
Echinococcus granulosus histone lysine methyltransferase setb 0.0036 0.0039 0.0039
Echinococcus multilocularis sodium leak channel non selective protein 0.0174 0.414 0.4139
Echinococcus granulosus potassium:sodium hyperpolarization activated 0.0174 0.414 0.414
Schistosoma mansoni aldehyde dehydrogenase 0.0073 0.1145 0.1143
Onchocerca volvulus Transient receptor potential cation channel trpm homolog 0.0174 0.414 0.5528
Echinococcus multilocularis conserved hypothetical protein 0.0174 0.414 0.4139
Echinococcus multilocularis potassium voltage gated channel protein 0.0174 0.414 0.4139
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.0174 0.414 0.4139
Echinococcus granulosus short transient receptor potential channel 6 0.0174 0.414 0.414
Schistosoma mansoni high voltage-activated calcium channel Cav2A 0.0174 0.414 0.4139
Echinococcus granulosus transient receptor potential cation channel 0.0174 0.414 0.414
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0174 0.414 0.4139
Trypanosoma cruzi Voltage-dependent calcium channel subunit, putative 0.0174 0.414 0.5
Toxoplasma gondii hypothetical protein 0.0174 0.414 1
Brugia malayi ion channel NompC 0.0174 0.414 0.644
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.0174 0.414 0.4139
Echinococcus multilocularis potassium voltage gated channel subfamily D 0.0174 0.414 0.4139
Loa Loa (eye worm) hypothetical protein 0.0174 0.414 0.4139
Schistosoma mansoni 60S ribosomal protein L21 0.0174 0.414 0.4139
Schistosoma mansoni voltage-dependent calcium channel 0.0174 0.414 0.4139
Echinococcus granulosus transient receptor potential cation channel 0.0174 0.414 0.414
Echinococcus multilocularis voltage gated potassium channel 0.0174 0.414 0.4139
Trypanosoma cruzi inositol 1,4,5-trisphosphate receptor, putative 0.0174 0.414 0.5
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0073 0.1145 0.5
Schistosoma mansoni voltage-gated potassium channel 0.0174 0.414 0.4139
Echinococcus granulosus voltage gated potassium channel 0.0174 0.414 0.414
Loa Loa (eye worm) hypothetical protein 0.0174 0.414 0.4139
Loa Loa (eye worm) hypothetical protein 0.0174 0.414 0.4139
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0609 0.0606
Brugia malayi Voltage-gated potassium channel, Shab-family (KCNB, Kv2-like) alpha-subunit 0.0174 0.414 0.644
Echinococcus multilocularis voltage gated hydrogen channel 1 0.0174 0.414 0.4139
Loa Loa (eye worm) hypothetical protein 0.0174 0.414 0.4139
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0174 0.414 0.4139
Echinococcus multilocularis voltage dependent calcium channel type d subunit 0.0174 0.414 0.4139
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0174 0.414 0.4139
Echinococcus granulosus transient receptor potential cation channel 0.0174 0.414 0.414
Echinococcus granulosus potassium voltage gated channel subfamily D 0.0174 0.414 0.414
Leishmania major calcium channel protein, putative,ion transporter, putative 0.0174 0.414 1
Echinococcus granulosus hyperpolarization activated cyclic 0.0174 0.414 0.414
Echinococcus granulosus short transient receptor potential channel 6 0.0174 0.414 0.414
Schistosoma mansoni voltage-gated potassium channel 0.0174 0.414 0.4139
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0036 0.0039 0.0036
Echinococcus multilocularis sodium channel protein 0.0174 0.414 0.4139
Loa Loa (eye worm) hypothetical protein 0.0174 0.414 0.4139
Echinococcus granulosus potassium voltage gated channel protein 0.0174 0.414 0.414
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0174 0.414 0.4139
Brugia malayi Voltage-gated potassium channel, Shaw-family (KCNC, Kv3-like) alpha-subunit 0.0174 0.414 0.644
Echinococcus multilocularis potassium voltage gated channel subfamily C 0.0174 0.414 0.4139
Schistosoma mansoni voltage-gated potassium channel 0.0174 0.414 0.4139
Echinococcus granulosus hypothetical protein 0.0174 0.414 0.414
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.0174 0.414 0.644
Schistosoma mansoni voltage-gated potassium channel 0.0174 0.414 0.4139
Echinococcus granulosus potassium voltage gated channel subfamily C 0.0174 0.414 0.414
Trichomonas vaginalis set domain proteins, putative 0.0286 0.7458 1
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.1145 0.5
Loa Loa (eye worm) cyclic-nucleotide gated cation channel 0.0174 0.414 0.4139
Loa Loa (eye worm) calcium channel 0.0174 0.414 0.4139
Echinococcus granulosus transient receptor potential gamma protein 0.0174 0.414 0.414
Echinococcus multilocularis two pore calcium channel protein 2 0.0174 0.414 0.4139
Echinococcus multilocularis shaker cognate 0.0174 0.414 0.4139
Brugia malayi Transient-receptor-potential like protein 0.0174 0.414 0.644
Loa Loa (eye worm) voltage-gated calcium channel 0.0174 0.414 0.4139
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0174 0.414 0.4139
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.0609 0.0606
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.0174 0.414 0.4139
Schistosoma mansoni voltage-gated potassium channel 0.0174 0.414 0.4139
Loa Loa (eye worm) hypothetical protein 0.0174 0.414 0.4139
Echinococcus granulosus voltage gated potassium channel 0.0174 0.414 0.414
Schistosoma mansoni transient receptor potential channel 4 0.0174 0.414 0.4139
Schistosoma mansoni voltage-gated potassium channel 0.0174 0.414 0.4139
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0036 0.0039 0.0036
Schistosoma mansoni voltage-gated potassium channel 0.0174 0.414 0.4139
Echinococcus granulosus two pore calcium channel protein 2 0.0174 0.414 0.414
Brugia malayi Voltage-gated calcium channel, L-type, alpha subunit. C. elegans egl-19 ortholog 0.0174 0.414 0.644
Echinococcus multilocularis voltage dependent calcium channel type d subunit 0.0174 0.414 0.4139

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 1.4125 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Aldehyde Dehydrogenase 1 (ALDH1A1). (Class of assay: confirmatory) [Related pubchem assays: 1030 (qHTS Validation Assay for Inhibitors of aldehyde dehydrogenase 1 (ALDH1A1))] ChEMBL. No reference
Potency (functional) 7.9433 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) 8.9125 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) 11.2202 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Rango (Ran-regulated importin-beta cargo) - Importin beta complex formation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID540273] ChEMBL. No reference
Potency (functional) 14.7157 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) 25.929 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in SW480 colon adenocarcinoma cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: VP16 counterscreen qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors and Activators of Human alpha-Galactosidase From Spleen Homogenate. (Class of assay: confirmatory) [Related pubchem assays: 1472, 1467 ] ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] 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.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

No literature references available for this target.

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