Detailed information for compound 180704

Basic information

Technical information
  • TDR Targets ID: 180704
  • Name: 8-chloro-1-cyclopropyl-7-(3,5-dimethylpiperaz in-1-yl)-6-fluoro-4-oxoquinoline-3-carboxylic acid
  • MW: 393.84 | Formula: C19H21ClFN3O3
  • H donors: 2 H acceptors: 3 LogP: 1.32 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC1NC(C)CN(C1)c1c(F)cc2c(c1Cl)n(cc(c2=O)C(=O)O)C1CC1
  • InChi: 1S/C19H21ClFN3O3/c1-9-6-23(7-10(2)22-9)17-14(21)5-12-16(15(17)20)24(11-3-4-11)8-13(18(12)25)19(26)27/h5,8-11,22H,3-4,6-7H2,1-2H3,(H,26,27)
  • InChiKey: PKKKDVJDIFMHHZ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 8-chloro-1-cyclopropyl-7-(3,5-dimethylpiperazin-1-yl)-6-fluoro-4-oxo-quinoline-3-carboxylic acid
  • 8-chloro-1-cyclopropyl-7-(3,5-dimethyl-1-piperazinyl)-6-fluoro-4-oxo-3-quinolinecarboxylic acid
  • 8-chloro-1-cyclopropyl-7-(3,5-dimethylpiperazino)-6-fluoro-4-keto-quinoline-3-carboxylic acid
  • 8-chloro-1-cyclopropyl-7-(3,5-dimethylpiperazin-1-yl)-6-fluoro-4-keto-quinoline-3-carboxylic acid
  • 103481-72-7
  • 3-Quinolinecarboxylic acid, 8-chloro-1-cyclopropyl-7-(3,5-dimethyl-1-piperazinyl)-6-fluoro-1,4-dihydro-4-oxo-
  • AIDS-105047
  • AIDS105047

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
Entamoeba histolytica Ran family GTPase 0.0021 0.0324 0.5174
Onchocerca volvulus 0.0016 0.0217 0.5
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0021 0.0324 0.137
Trichomonas vaginalis glucose transporter, putative 0.0034 0.0621 0.274
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Loa Loa (eye worm) hypothetical protein 0.0048 0.0921 0.1441
Schistosoma mansoni sugar transporter 0.0016 0.0217 0.032
Echinococcus multilocularis calcium dependent protein kinase 0.0032 0.0566 0.0877
Echinococcus multilocularis importin subunit beta 1 0.0028 0.0483 0.0743
Trypanosoma cruzi threonyl-tRNA synthetase, putative 0.0006 0.0016 0.0218
Plasmodium vivax calcium-dependent protein kinase 1, putative 0.0034 0.0612 0.0597
Toxoplasma gondii prolyl-tRNA synthetase (ProRS) 0.0039 0.0715 0.1081
Trypanosoma cruzi prolyl-tRNA synthetase, putative 0.0039 0.0715 1
Loa Loa (eye worm) hypothetical protein 0.0027 0.0463 0.0711
Trichomonas vaginalis conserved hypothetical protein 0.0016 0.0217 0.0956
Plasmodium vivax hexose transporter 0.0111 0.2266 0.2253
Trichomonas vaginalis sugar transport protein, putative 0.0016 0.0217 0.0956
Plasmodium falciparum lysine--tRNA ligase 0.0025 0.0414 0.0399
Toxoplasma gondii sugar transporter ST3 0.0016 0.0217 0.0327
Mycobacterium leprae Probable threonyl-tRNA synthetase ThrS (threonine-tRNA synthetase) (ThrRS) (Threonine-tRNA ligase) 0.0006 0.0016 0.0262
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Loa Loa (eye worm) hypothetical protein 0.0034 0.0611 0.0948
Plasmodium falciparum major facilitator superfamily domain-containing protein, putative 0.0016 0.0217 0.0201
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Loa Loa (eye worm) hypothetical protein 0.0025 0.0414 0.0633
Leishmania major GTP-binding protein, putative 0.0021 0.0324 0.4529
Leishmania major glucose transporter, lmgt2 0.0034 0.0621 0.868
Schistosoma mansoni hypothetical protein 0.0298 0.6299 1
Toxoplasma gondii threonyl-tRNA synthetase family protein 0.0006 0.0016 0.0024
Mycobacterium ulcerans sugar transporter 0.0016 0.0217 0.5239
Plasmodium vivax proline--tRNA ligase, putative 0.0039 0.0715 0.0701
Trypanosoma cruzi hexose transporter, putative 0.0034 0.0621 0.868
Brugia malayi Calcium/calmodulin-dependent protein kinase type II alpha chain 0.0034 0.0611 0.2648
Schistosoma mansoni hypothetical protein 0.0015 0.021 0.031
Echinococcus granulosus solute carrier family 22 0.0016 0.0217 0.032
Echinococcus granulosus GTP binding nuclear protein Ran 0.0021 0.0324 0.0491
Leishmania major threonyl-tRNA synthetase, putative 0.0006 0.0016 0.0218
Trichomonas vaginalis CAMK family protein kinase 0.0034 0.0611 0.2699
Trypanosoma cruzi prolyl-tRNA synthetase, putative 0.0039 0.0715 1
Onchocerca volvulus 0.0016 0.0217 0.5
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Brugia malayi lysyl-tRNA synthetase 0.0025 0.0414 0.1769
Trypanosoma cruzi hexose transporter, putative 0.0034 0.0621 0.868
Plasmodium falciparum protein kinase 7 0.0313 0.6617 0.6612
Trichomonas vaginalis sugar transporter, putative 0.0034 0.0621 0.274
Echinococcus multilocularis snurportin 1 0.0298 0.6299 1
Echinococcus multilocularis General substrate transporter 0.0095 0.193 0.3047
Brugia malayi Major Facilitator Superfamily protein 0.0016 0.0217 0.0894
Entamoeba histolytica protein kinase, putative 0.0034 0.0611 1
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Loa Loa (eye worm) hypothetical protein 0.0016 0.0217 0.032
Plasmodium falciparum hexose transporter 0.0111 0.2266 0.2253
Schistosoma mansoni ran 0.0021 0.0324 0.0491
Leishmania major importin beta-1 subunit, putative 0.0023 0.0369 0.5158
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0015 0.021 0.031
Trypanosoma cruzi glucose transporter, putative 0.0016 0.0217 0.303
Plasmodium vivax mitogen-activated protein kinase 2, putative 0.0179 0.3734 0.3724
Trichomonas vaginalis importin beta-1, putative 0.0023 0.0369 0.1628
Echinococcus granulosus importin subunit beta 1 0.0028 0.0483 0.0743
Plasmodium falciparum importin beta, putative 0.0028 0.0483 0.0468
Leishmania major myo-inositol/proton symporter (MIT) 0.0016 0.0217 0.303
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Echinococcus multilocularis solute carrier family 2, facilitated glucose 0.0111 0.2266 0.3581
Loa Loa (eye worm) hypothetical protein 0.0016 0.0217 0.032
Leishmania major lysyl-tRNA synthetase, putative 0.0025 0.0414 0.5783
Echinococcus multilocularis solute carrier family 22 0.0016 0.0217 0.032
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Entamoeba histolytica prolyl-tRNA synthetase, putative 0.0033 0.0597 0.9752
Trichomonas vaginalis sugar transporter, putative 0.0034 0.0621 0.274
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0021 0.0324 0.0491
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Onchocerca volvulus 0.0016 0.0217 0.5
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0034 0.0611 0.0948
Trypanosoma brucei importin beta-1 subunit, putative 0.0028 0.0483 0.6748
Onchocerca volvulus 0.0016 0.0217 0.5
Trichomonas vaginalis myo-inositol transporter, putative 0.0016 0.0217 0.0956
Onchocerca volvulus 0.0016 0.0217 0.5
Plasmodium vivax calcium-dependent protein kinase 4, putative 0.0034 0.0612 0.0597
Trypanosoma brucei lysyl-tRNA synthetase, putative 0.0025 0.0414 0.5783
Brugia malayi Cam kinase protein 1 0.0034 0.0611 0.2648
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Schistosoma mansoni protein kinase 0.0034 0.0611 0.0948
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0021 0.0324 0.4529
Echinococcus multilocularis lysyl tRNA synthetase 0.0025 0.0414 0.0633
Loa Loa (eye worm) sugar transporter 0.0016 0.0217 0.032
Brugia malayi hypothetical protein 0.0016 0.0217 0.0894
Mycobacterium leprae Probable prolyl tRNA synthetase ProS 0.0033 0.0597 1
Schistosoma mansoni hypothetical protein 0.0015 0.021 0.031
Trichomonas vaginalis glucose transporter, putative 0.0034 0.0621 0.274
Onchocerca volvulus 0.0016 0.0217 0.5
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0111 0.2266 0.3581
Echinococcus multilocularis solute carrier family 22 0.0016 0.0217 0.032
Toxoplasma gondii sugar transporter ST1 0.0016 0.0217 0.0327
Brugia malayi Major Facilitator Superfamily protein 0.0016 0.0217 0.0894
Trypanosoma brucei THT1 - hexose transporter, putative 0.0034 0.0621 0.868
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0021 0.0324 0.5305
Loa Loa (eye worm) hypothetical protein 0.0016 0.0217 0.032
Giardia lamblia Lysyl-tRNA synthetase 0.0025 0.0414 0.6849
Trichomonas vaginalis conserved hypothetical protein 0.0111 0.2266 1
Echinococcus multilocularis Sugar transporter ERD6 protein 0.0016 0.0217 0.032
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0034 0.0611 0.0948
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Mycobacterium tuberculosis Lysyl-tRNA synthetase 1 LysS (lysine--tRNA ligase 1) (LysRS 1) (lysine translase) 0.0021 0.0333 1
Leishmania major glucose transporter, lmgt1 0.0034 0.0621 0.868
Leishmania major glucose transporter, lmgt3 0.0034 0.0621 0.868
Echinococcus multilocularis glutamyl tRNA synthetase cytoplasmic 0.0033 0.0597 0.0925
Brugia malayi hypothetical protein 0.0016 0.0217 0.0894
Trypanosoma brucei glucose transporter, putative 0.0034 0.0621 0.868
Trypanosoma cruzi hexose transporter, putative 0.0034 0.0621 0.868
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Trichomonas vaginalis conserved hypothetical protein 0.0034 0.0621 0.274
Trichomonas vaginalis glucose transporter, putative 0.0016 0.0217 0.0956
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Loa Loa (eye worm) calcium/calmodulin-dependent protein kinase ID 0.0034 0.0611 0.0948
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0021 0.0324 0.0491
Onchocerca volvulus 0.0016 0.0217 0.5
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0015 0.021 0.031
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0111 0.2266 0.3581
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0015 0.021 0.0865
Loa Loa (eye worm) major facilitator superfamily transporter 0.0016 0.0217 0.032
Wolbachia endosymbiont of Brugia malayi major facilitator superfamily permease 0.0016 0.0217 1
Trichomonas vaginalis ran, putative 0.0021 0.0324 0.143
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0023 0.0369 0.1628
Loa Loa (eye worm) latrophilin receptor protein 2 0.0015 0.021 0.031
Trypanosoma cruzi threonyl-tRNA synthetase, putative 0.0006 0.0016 0.0218
Trypanosoma brucei myo-inositol/proton symporter (MIT) 0.0016 0.0217 0.303
Onchocerca volvulus 0.0016 0.0217 0.5
Plasmodium vivax lysine--tRNA ligase, putative 0.0025 0.0414 0.0399
Onchocerca volvulus Putative transporter 0.0016 0.0217 0.5
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0298 0.6299 1
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Schistosoma mansoni sugar transporter 0.0016 0.0217 0.032
Onchocerca volvulus 0.0016 0.0217 0.5
Schistosoma mansoni nuclear transcription factor X-box binding 1 (nfx1) 0.0016 0.0217 0.032
Brugia malayi Major Facilitator Superfamily protein 0.0016 0.0217 0.0894
Loa Loa (eye worm) sugar transporter 0.0111 0.2266 0.3581
Schistosoma mansoni glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs) 0.0033 0.0597 0.0925
Trypanosoma brucei importin beta-1 subunit, putative 0.0028 0.0483 0.6748
Plasmodium vivax CDK-related protein kinase 6, putative 0.047 1 1
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 0.0021 0.0324 0.0489
Echinococcus multilocularis solute carrier family 22 0.0016 0.0217 0.032
Echinococcus granulosus General substrate transporter 0.0095 0.193 0.3047
Loa Loa (eye worm) hypothetical protein 0.0016 0.0217 0.032
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0111 0.2266 0.3581
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Loa Loa (eye worm) hypothetical protein 0.0016 0.0217 0.032
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Brugia malayi Sugar transporter family protein 0.0111 0.2266 1
Trypanosoma brucei glucose transporter, putative 0.0034 0.0621 0.868
Loa Loa (eye worm) hypothetical protein 0.0016 0.0217 0.032
Schistosoma mansoni hypothetical protein 0.0111 0.2266 0.3581
Trypanosoma brucei glucose transporter 2A 0.0034 0.0621 0.868
Mycobacterium ulcerans prolyl-tRNA synthetase 0.0012 0.0134 0.3243
Plasmodium falciparum calcium-dependent protein kinase 4 0.0034 0.0612 0.0597
Leishmania major glucose transporter/membrane transporter D2, putative 0.0034 0.0621 0.868
Echinococcus granulosus solute carrier family 22 0.0016 0.0217 0.032
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0048 0.0921 0.1441
Brugia malayi Sugar transporter family protein 0.0016 0.0217 0.0894
Onchocerca volvulus 0.0016 0.0217 0.5
Mycobacterium ulcerans fusion protein of transposase for IS2606 and sialic acid-transport integral membrane protein NanT 0.0016 0.0217 0.5239
Schistosoma mansoni lysyl-tRNA synthetase 0.0025 0.0414 0.0633
Brugia malayi RNA, U transporter 1 0.0079 0.1591 0.7002
Plasmodium vivax calcium-dependent protein kinase 3, putative 0.0034 0.0612 0.0597
Trypanosoma brucei calcium/calmodulin-dependent protein kinase, putative 0.0034 0.0611 0.855
Trypanosoma cruzi hexose transporter 0.0034 0.0621 0.868
Giardia lamblia Prolyl-tRNA synthetase 0.0033 0.0597 1
Echinococcus multilocularis GPCR, family 2 0.0015 0.021 0.031
Plasmodium falciparum calcium-dependent protein kinase 1 0.0034 0.0612 0.0597
Echinococcus granulosus glutamyl tRNA synthetase cytoplasmic 0.0033 0.0597 0.0925
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0034 0.0611 0.0948
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0034 0.0611 0.0948
Trypanosoma brucei glucose transporter, putative 0.0034 0.0621 0.868
Echinococcus granulosus snurportin 1 0.0298 0.6299 1
Giardia lamblia Sugar-proton symporter 0.0016 0.0217 0.346
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0021 0.0324 0.0309
Trichomonas vaginalis conserved hypothetical protein 0.0016 0.0217 0.0956
Brugia malayi hypothetical protein 0.0016 0.0217 0.0894
Echinococcus granulosus calcium dependent protein kinase 0.0032 0.0566 0.0877
Loa Loa (eye worm) hypothetical protein 0.0033 0.0597 0.0925
Schistosoma mansoni sugar transporter 0.0016 0.0217 0.032
Trypanosoma brucei glycyl-tRNA synthetase, putative 0.0006 0.0016 0.0218
Onchocerca volvulus 0.0016 0.0217 0.5
Echinococcus granulosus Sugar transporter ERD6 protein 0.0016 0.0217 0.032
Trichomonas vaginalis conserved hypothetical protein 0.0016 0.0217 0.0956
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Toxoplasma gondii facilitative glucose transporter GT1 0.0111 0.2266 0.3424
Schistosoma mansoni hypothetical protein 0.0015 0.021 0.031
Schistosoma mansoni glucose transport protein 0.0111 0.2266 0.3581
Treponema pallidum prolyl-tRNA synthetase 0.0012 0.0134 1
Trichomonas vaginalis prolyl-tRNA synthetase, putative 0.0033 0.0597 0.2634
Trichomonas vaginalis lysyl-tRNA synthetase, putative 0.0022 0.0348 0.1536
Trypanosoma brucei glucose transporter, putative 0.0034 0.0621 0.868
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0015 0.021 0.031
Plasmodium falciparum calcium-dependent protein kinase 3 0.0034 0.0612 0.0597
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 1 0.0034 0.0611 0.0948
Trypanosoma cruzi importin beta-1 subunit, putative 0.0023 0.0369 0.5158
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Echinococcus granulosus lysyl tRNA synthetase 0.0025 0.0414 0.0633
Schistosoma mansoni glucose transport protein 0.0111 0.2266 0.3581
Loa Loa (eye worm) hypothetical protein 0.0016 0.0217 0.032
Loa Loa (eye worm) hypothetical protein 0.0016 0.0217 0.032
Trypanosoma brucei glucose transporter, putative 0.0034 0.0621 0.868
Loa Loa (eye worm) hypothetical protein 0.0028 0.0483 0.0743
Entamoeba histolytica hypothetical protein 0.0023 0.0369 0.5929
Onchocerca volvulus 0.0016 0.0217 0.5
Brugia malayi major facilitator superfamily protein 0.0016 0.0217 0.0894
Trypanosoma brucei glucose transporter, putative 0.0034 0.0621 0.868
Brugia malayi Bifunctional aminoacyl-tRNA synthetase 0.0033 0.0597 0.2583
Mycobacterium ulcerans sugar-transport integral membrane protein SugI 0.0016 0.0217 0.5239
Leishmania major hypothetical protein, conserved 0.0016 0.0217 0.303
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0023 0.0369 0.1628
Schistosoma mansoni glucose transport protein 0.0111 0.2266 0.3581
Trypanosoma brucei glucose transporter 1E 0.0034 0.0621 0.868
Schistosoma mansoni protein kinase 0.0034 0.0611 0.0948
Trypanosoma brucei ULK family serine/threonine-protein kinase, putative 0.0007 0.0041 0.057
Onchocerca volvulus 0.0016 0.0217 0.5
Toxoplasma gondii glycyl-tRNA synthetase 0.0006 0.0016 0.0024
Loa Loa (eye worm) major facilitator superfamily transporter 0.0016 0.0217 0.032
Trichomonas vaginalis threonyl-tRNA synthetase, putative 0.0006 0.0016 0.0069
Toxoplasma gondii calcium-dependent protein kinase CDPK2A 0.0034 0.0612 0.0925
Trypanosoma brucei THT1 - hexose transporter, putative 0.0034 0.0621 0.868
Schistosoma mansoni protein kinase 0.0034 0.0611 0.0948
Toxoplasma gondii protein kinase, putative 0.0313 0.6617 1
Toxoplasma gondii cell-cycle-associated protein kinase MAPK, putative 0.0179 0.3734 0.5643
Schistosoma mansoni glucose transporter 0.0016 0.0217 0.032
Leishmania major prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative 0.0039 0.0715 1
Loa Loa (eye worm) hypothetical protein 0.0016 0.0217 0.032
Giardia lamblia Hexose transporter 0.0016 0.0217 0.346
Brugia malayi Latrophilin receptor protein 2 0.0015 0.021 0.0865
Plasmodium falciparum mitogen-activated protein kinase 2 0.0179 0.3734 0.3724
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0111 0.2266 0.3581
Plasmodium falciparum proline--tRNA ligase 0.0039 0.0715 0.0701
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0015 0.021 0.031
Schistosoma mansoni serine/threonine protein kinase 0.0034 0.0611 0.0948
Loa Loa (eye worm) hypothetical protein 0.0016 0.0217 0.032
Echinococcus granulosus solute carrier family 22 0.0016 0.0217 0.032
Loa Loa (eye worm) bifunctional aminoacyl-tRNA synthetase 0.0014 0.0175 0.0254
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Onchocerca volvulus 0.0016 0.0217 0.5
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0048 0.0921 0.4023
Entamoeba histolytica hypothetical protein 0.0025 0.0414 0.6679
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0111 0.2266 0.3581
Schistosoma mansoni hypothetical protein 0.0033 0.0592 0.0917
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0034 0.0611 0.0948
Leishmania major protein kinase, putative 0.0034 0.0611 0.855
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0111 0.2266 0.3581
Loa Loa (eye worm) CAMK/CAMK2 protein kinase 0.0034 0.0611 0.0948
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0021 0.0324 0.0309
Loa Loa (eye worm) hypothetical protein 0.0016 0.0217 0.032
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0034 0.0611 0.0948
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Brugia malayi major facilitator superfamily protein 0.0016 0.0217 0.0894
Schistosoma mansoni lysyl-tRNA synthetase 0.0025 0.0414 0.0633
Trypanosoma cruzi hexose transporter, putative 0.0016 0.0217 0.303
Toxoplasma gondii lysine-tRNA ligase 0.0025 0.0414 0.0625
Loa Loa (eye worm) hypothetical protein 0.0016 0.0217 0.032
Onchocerca volvulus 0.0016 0.0217 0.5
Echinococcus multilocularis solute carrier family 22 0.0016 0.0217 0.032
Echinococcus granulosus solute carrier family 22 0.0016 0.0217 0.032
Trichomonas vaginalis conserved hypothetical protein 0.0034 0.0621 0.274
Mycobacterium leprae Possible lysyl-tRNA synthetase 2 LysX 0.0025 0.0414 0.6932
Mycobacterium ulcerans threonyl-tRNA synthetase 0.0006 0.0016 0.0377
Echinococcus granulosus GPCR family 2 0.0015 0.021 0.031
Toxoplasma gondii calcium-dependent protein kinase CDPK2B 0.0034 0.0612 0.0925
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Mycobacterium leprae Probable lysyl-tRNA synthase LysS (lysine--tRNA ligase 1) (LysRS 1) (lysine translase) 0.0021 0.0333 0.5587
Entamoeba histolytica protein kinase, putative 0.0034 0.0611 1
Brugia malayi Sugar transporter family protein 0.0016 0.0217 0.0894
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Loa Loa (eye worm) hypothetical protein 0.0015 0.021 0.031
Mycobacterium ulcerans lysyl-tRNA synthetase 0.0025 0.0414 1
Mycobacterium tuberculosis Probable conserved integral membrane transport protein 0.0016 0.0217 0.6499
Trypanosoma brucei THT1 - hexose transporter, putative 0.0034 0.0621 0.868
Trichomonas vaginalis conserved hypothetical protein 0.0016 0.0217 0.0956
Chlamydia trachomatis proline--tRNA ligase 0.0012 0.0134 0.2978
Brugia malayi Importin beta-1 subunit 0.0028 0.0483 0.2076
Chlamydia trachomatis lysine--tRNA ligase 0.0025 0.0414 1
Trypanosoma cruzi hexose transporter, putative 0.0019 0.0286 0.3994
Plasmodium falciparum calcium-dependent protein kinase 5 0.0034 0.0612 0.0597
Schistosoma mansoni glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs) 0.0033 0.0597 0.0925
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Trichomonas vaginalis lysyl-tRNA synthetase, putative 0.0025 0.0414 0.1826
Loa Loa (eye worm) hypothetical protein 0.0033 0.0597 0.0925
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0111 0.2266 0.3581
Leishmania major prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative 0.0039 0.0715 1
Trypanosoma brucei glucose transporter, putative 0.0034 0.0621 0.868
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Brugia malayi latrophilin 2 splice variant baaae 0.0033 0.0592 0.2562
Plasmodium falciparum calcium-dependent protein kinase 2 0.0034 0.0612 0.0597
Onchocerca volvulus 0.0016 0.0217 0.5
Loa Loa (eye worm) hypothetical protein 0.0016 0.0217 0.032
Loa Loa (eye worm) hypothetical protein 0.0016 0.0217 0.032
Trypanosoma brucei glucose transporter, putative 0.0034 0.0621 0.868
Mycobacterium ulcerans lysyl-tRNA synthetase 0.0025 0.0414 1
Trypanosoma cruzi lysyl-tRNA synthetase, putative 0.0025 0.0414 0.5783
Schistosoma mansoni sugar transporter 0.0016 0.0217 0.032
Schistosoma mansoni ran 0.0021 0.0324 0.0491
Mycobacterium tuberculosis Probable threonyl-tRNA synthetase ThrS (threonine-tRNA synthetase)(ThrRS) (threonine-tRNA ligase) 0.0006 0.0016 0.0468
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative 0.0021 0.0324 0.4529
Mycobacterium tuberculosis Lysyl-tRNA synthetase 2 LysX 0.0021 0.0333 1
Toxoplasma gondii sugar transporter ST2 0.0016 0.0217 0.0327
Plasmodium vivax importin-beta 2, putative 0.0028 0.0483 0.0468
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Trichomonas vaginalis conserved hypothetical protein 0.0016 0.0217 0.0956
Trichomonas vaginalis sugar transporter, putative 0.0034 0.0621 0.274
Mycobacterium ulcerans integral membrane transport protein 0.0016 0.0217 0.5239
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0021 0.0324 0.4529
Toxoplasma gondii calcium-dependent protein kinase CDPK3 0.0034 0.0612 0.0925
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Trypanosoma cruzi sugar transporter, putative 0.0016 0.0217 0.303
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Toxoplasma gondii transporter, major facilitator family protein 0.0016 0.0217 0.0327
Brugia malayi Calcitonin receptor-like protein seb-1 0.0048 0.0921 0.4023
Echinococcus multilocularis synaptic vesicle 2 protein 0.0016 0.0217 0.032
Echinococcus granulosus synaptic vesicle 2 protein 0.0016 0.0217 0.032
Schistosoma mansoni importin beta-1 0.0028 0.0483 0.0743
Schistosoma mansoni hypothetical protein 0.0015 0.021 0.031
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Toxoplasma gondii HEAT repeat-containing protein 0.0028 0.0483 0.0729
Trypanosoma brucei threonyl-tRNA synthetase, putative 0.0006 0.0016 0.0218
Plasmodium vivax sugar transporter, putative 0.0016 0.0217 0.0201
Brugia malayi bifunctional aminoacyl-tRNA synthetase 0.0033 0.0597 0.2583
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0034 0.0611 0.0948
Plasmodium vivax calcium-dependent protein kinase, putative 0.0034 0.0612 0.0597
Loa Loa (eye worm) hypothetical protein 0.0016 0.0217 0.032
Trypanosoma brucei sugar transporter, putative 0.0016 0.0217 0.303
Loa Loa (eye worm) hypothetical protein 0.0033 0.0592 0.0917
Trypanosoma brucei bifunctional aminoacyl-tRNA synthetase, putative 0.0039 0.0715 1
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956
Mycobacterium ulcerans glycyl-tRNA synthetase 0.0006 0.0016 0.0377
Mycobacterium tuberculosis Probable dicarboxylic acid transport integral membrane protein KgtP (dicarboxylate transporter) 0.0016 0.0217 0.6499
Trichomonas vaginalis sugar transporter, putative 0.0016 0.0217 0.0956

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) = 140 ug ml-1 Mammalian cell cytotoxicity test in chinese hamster V79 cells (clonogenic cytotoxicity) ChEMBL. 1469702
Log 1/C (functional) = 7.16 Antibacterial activity was evaluated against Escherichia coli ChEMBL. 15163198
Log 1/C (functional) = 5.63 Antibacterial activity was evaluated against Pseudomonas aeruginosa ChEMBL. 15163198
Log 1/C (functional) = 5.93 Antibacterial activity evaluated against Enterococcus faecalis ChEMBL. 15163198
Log 1/C (functional) = 6.54 Antibacterial activity of the compound was evaluated against Staphylococcus aureus ChEMBL. 15163198
Log 1/C (functional) = 7.16 Antibacterial activity was evaluated against Escherichia coli ChEMBL. 15163198
MIC (functional) = 0.23 ug ml-1 Antibacterial activity against five Gram-negative bacteria ChEMBL. 1469702
MIC (functional) = 0.26 ug ml-1 Antibacterial activity against five Gram-positive bacteria targeting topoisomerase II (DNA gyrase B GyrB) ChEMBL. 1469702
MIC (functional) = 0.26 ug ml-1 Antibacterial activity against five Gram-positive bacteria targeting topoisomerase II (DNA gyrase B GyrB) ChEMBL. 1469702

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.
 
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

2 literature references were collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.