Detailed information for compound 1289935

Basic information

Technical information
  • TDR Targets ID: 1289935
  • Name: 2-(cyclohexylcarbamoylamino)-N-(furan-2-ylmet hyl)benzamide
  • MW: 341.404 | Formula: C19H23N3O3
  • H donors: 3 H acceptors: 2 LogP: 3.16 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(Nc1ccccc1C(=O)NCc1ccco1)NC1CCCCC1
  • InChi: 1S/C19H23N3O3/c23-18(20-13-15-9-6-12-25-15)16-10-4-5-11-17(16)22-19(24)21-14-7-2-1-3-8-14/h4-6,9-12,14H,1-3,7-8,13H2,(H,20,23)(H2,21,22,24)
  • InChiKey: HBEKESMRDMQVJK-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 2-(cyclohexylcarbamoylamino)-N-(2-furylmethyl)benzamide
  • 2-[[(cyclohexylamino)-oxomethyl]amino]-N-(2-furylmethyl)benzamide
  • MLS000041030
  • AJ-292/15007023
  • 2-(3-Cyclohexyl-ureido)-N-furan-2-ylmethyl-benzamide
  • Oprea1_652846
  • Oprea1_197868
  • SMR000046392
  • ARONIS010738
  • BAS 12410956
  • ZINC04295880
  • ALD-N011755

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Bacillus subtilis (strain 168) ATP-dependent Clp protease proteolytic subunit Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit Get druggable targets OG5_127187 All targets in OG5_127187
Schistosoma japonicum ko:K01358 ATP-dependent Clp protease, protease subunit [EC3.4.21.92], putative Get druggable targets OG5_127187 All targets in OG5_127187
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit Get druggable targets OG5_127187 All targets in OG5_127187
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit Get druggable targets OG5_127187 All targets in OG5_127187
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127187 All targets in OG5_127187
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein Get druggable targets OG5_127187 All targets in OG5_127187
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) Get druggable targets OG5_127187 All targets in OG5_127187
Brugia malayi Probable ClpP-like protease Get druggable targets OG5_127187 All targets in OG5_127187
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative Get druggable targets OG5_127187 All targets in OG5_127187
Plasmodium berghei ATP-dependent Clp protease proteolytic subunit, putative Get druggable targets OG5_127187 All targets in OG5_127187
Theileria parva ATP-dependent Clp protease proteolytic subunit, putative Get druggable targets OG5_127187 All targets in OG5_127187
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit Get druggable targets OG5_127187 All targets in OG5_127187
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) Get druggable targets OG5_127187 All targets in OG5_127187
Plasmodium yoelii ATP-dependent Clp protease, proteolytic subunit ClpP, putative Get druggable targets OG5_127187 All targets in OG5_127187
Echinococcus multilocularis peptidase Clp (S14 family) Get druggable targets OG5_127187 All targets in OG5_127187
Babesia bovis ATP-dependent Clp protease proteolytic subunit 1, putative Get druggable targets OG5_127187 All targets in OG5_127187
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein Get druggable targets OG5_127187 All targets in OG5_127187
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit Get druggable targets OG5_127187 All targets in OG5_127187
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit Get druggable targets OG5_127187 All targets in OG5_127187
Plasmodium knowlesi ATP-dependent Clp protease proteolytic subunit, putative Get druggable targets OG5_127187 All targets in OG5_127187
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit Get druggable targets OG5_127187 All targets in OG5_127187
Echinococcus granulosus peptidase Clp S14 family Get druggable targets OG5_127187 All targets in OG5_127187
Neospora caninum ATP-dependent Clp protease proteolytic subunit, related Get druggable targets OG5_127187 All targets in OG5_127187
Treponema pallidum ATP-dependent Clp protease proteolytic subunit Get druggable targets OG5_127187 All targets in OG5_127187
Theileria parva ATP-dependent Clp protease proteolytic subunit, putative Get druggable targets OG5_127187 All targets in OG5_127187
Schistosoma japonicum ko:K06275 parvin, putative Get druggable targets OG5_127187 All targets in OG5_127187
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit Get druggable targets OG5_127187 All targets in OG5_127187
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) Get druggable targets OG5_127187 All targets in OG5_127187
Schistosoma mansoni peptidase Clp (S14 family) Get druggable targets OG5_127187 All targets in OG5_127187
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) Get druggable targets OG5_127187 All targets in OG5_127187
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Plasmodium knowlesi ATP-dependent Clp protease proteolytic subunit, putative ATP-dependent Clp protease proteolytic subunit   197 aa 189 aa 36.0 %
Chlamydia trachomatis hypothetical protein ATP-dependent Clp protease proteolytic subunit   197 aa 171 aa 22.8 %
Mycobacterium leprae ATP-dependent Clp protease proteolytic subunit 1 ATP-dependent Clp protease proteolytic subunit   197 aa 172 aa 57.0 %
Treponema pallidum ATP-dependent Clp protease proteolytic subunit ATP-dependent Clp protease proteolytic subunit   197 aa 186 aa 40.3 %
Babesia bovis ATP-dependent Clp protease proteolytic subunit, putative ATP-dependent Clp protease proteolytic subunit   197 aa 188 aa 41.5 %
Plasmodium yoelii Clp protease ATP-dependent Clp protease proteolytic subunit   197 aa 183 aa 36.6 %
Onchocerca volvulus Putative V-type proton ATPase subunit F ATP-dependent Clp protease proteolytic subunit   197 aa 194 aa 54.1 %
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative ATP-dependent Clp protease proteolytic subunit   197 aa 189 aa 35.5 %
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit ATP-dependent Clp protease proteolytic subunit   197 aa 183 aa 36.1 %
Schistosoma mansoni neuropeptide receptor ATP-dependent Clp protease proteolytic subunit   197 aa 174 aa 20.1 %
Plasmodium berghei ATP-dependent Clp protease proteolytic subunit, putative ATP-dependent Clp protease proteolytic subunit   197 aa 180 aa 36.7 %
Babesia bovis ATP-dependent Clp protease proteolytic subunit, putative ATP-dependent Clp protease proteolytic subunit   197 aa 188 aa 41.5 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) hypothetical protein 0.007 0.1538 0.1837
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0032 0.0397 0.0376
Loa Loa (eye worm) hypothetical protein 0.0143 0.3716 0.4438
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0094 0.226 0.2243
Trypanosoma cruzi Present in the outer mitochondrial membrane proteome 4 0.0036 0.0514 0.7724
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0094 0.226 1
Brugia malayi Bromodomain containing protein 0.0075 0.1689 0.1839
Plasmodium falciparum ataxin-2 like protein, putative 0.0027 0.0253 0.1121
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0052 0.0986 0.0967
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0039 0.0591 0.1681
Trypanosoma cruzi Present in the outer mitochondrial membrane proteome 4 0.0036 0.0514 0.7724
Echinococcus granulosus survival motor neuron protein 1 0.0271 0.7554 0.7549
Echinococcus multilocularis musashi 0.0146 0.3796 0.3783
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0025 0.0192 0.1494
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0146 0.3796 0.4533
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.0062 0.1286 1
Echinococcus granulosus neutral alpha glucosidase AB 0.0039 0.0591 0.0571
Brugia malayi Glycosyl hydrolases family 31 protein 0.0174 0.4652 0.5457
Echinococcus multilocularis lamin 0.0146 0.3796 0.3783
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0025 0.0192 0.0229
Schistosoma mansoni bromodomain containing protein 0.0064 0.1336 0.1498
Loa Loa (eye worm) hypothetical protein 0.0025 0.0192 0.0229
Brugia malayi hypothetical protein 0.0271 0.7554 0.8999
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0023 0.0111 0.0102
Toxoplasma gondii hypothetical protein 0.0033 0.0406 0.0763
Schistosoma mansoni hypothetical protein 0.0021 0.0053 0.0036
Plasmodium vivax FAD-linked sulfhydryl oxidase ERV1, putative 0.0036 0.0514 0.2274
Mycobacterium ulcerans glutaminase 0.0299 0.8374 1
Brugia malayi Pre-SET motif family protein 0.0032 0.0397 0.0262
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.0062 0.1286 1
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.0062 0.1286 0.5289
Brugia malayi Pre-SET motif family protein 0.0225 0.6155 0.7291
Echinococcus granulosus FAD linked sulfhydryl oxidase ALR 0.0036 0.0514 0.0494
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0094 0.226 0.2698
Onchocerca volvulus 0.0051 0.0973 0.1133
Brugia malayi Augmenter of liver regeneration 0.0036 0.0514 0.0405
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0052 0.0986 0.0967
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0094 0.226 0.2243
Mycobacterium ulcerans hypothetical protein 0.0025 0.0192 0.0229
Brugia malayi cytoplasmic intermediate filament protein 0.0078 0.177 0.1939
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0052 0.0986 0.1099
Loa Loa (eye worm) hypothetical protein 0.0025 0.0192 0.0229
Echinococcus granulosus lysosomal alpha glucosidase 0.0174 0.4652 0.4641
Onchocerca volvulus 0.0055 0.1089 0.1302
Mycobacterium leprae ATP-dependent Clp protease proteolytic subunit 1 0.0033 0.0406 0.1037
Loa Loa (eye worm) hypothetical protein 0.0071 0.156 0.1863
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0059 0.1186 0.1226
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0051 0.0973 0.1084
Echinococcus multilocularis neutral alpha glucosidase AB 0.0039 0.0591 0.0571
Schistosoma mansoni alpha-glucosidase 0.015 0.3925 0.4448
Loa Loa (eye worm) hypothetical protein 0.0041 0.0658 0.0786
Brugia malayi intermediate filament protein 0.0146 0.3796 0.4412
Echinococcus multilocularis histone acetyltransferase MYST2 0.0059 0.1186 0.1168
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0094 0.226 1
Trypanosoma brucei glucosidase, putative 0.0039 0.0591 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0052 0.0986 0.1099
Brugia malayi AMP-binding enzyme family protein 0.0025 0.0192 0.0012
Schistosoma mansoni intermediate filament proteins 0.0146 0.3796 0.4301
Leishmania major hypothetical protein, conserved 0.0027 0.0253 0.1538
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0049 0.091 0.1012
Echinococcus granulosus intermediate filament protein 0.0146 0.3796 0.3783
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0039 0.0591 1
Schistosoma mansoni sex comb on midleg homolog 0.0051 0.0973 0.1084
Echinococcus multilocularis FAD linked sulfhydryl oxidase ALR 0.0036 0.0514 0.0494
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0052 0.0986 0.1178
Brugia malayi Intermediate filament tail domain containing protein 0.0146 0.3796 0.4412
Echinococcus multilocularis polycomb protein SCMH1 0.0051 0.0973 0.0954
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0032 0.0397 0.0714
Schistosoma mansoni myelin transcription factor 1 myt1 0.0059 0.1186 0.1327
Toxoplasma gondii Erv1 / Alr family protein 0.0036 0.0514 0.1299
Loa Loa (eye worm) glutaminase 0.0299 0.8374 1
Brugia malayi mbt repeat family protein 0.0051 0.0973 0.0966
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0078 0.177 0.2114
Echinococcus multilocularis lysosomal alpha glucosidase 0.0174 0.4652 0.4641
Schistosoma mansoni survival motor neuron protein 0.0055 0.1089 0.1216
Schistosoma mansoni glutaminase 0.0299 0.8374 0.9516
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0039 0.0591 0.0705
Echinococcus granulosus lamin 0.0146 0.3796 0.3783
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0094 0.226 0.2698
Echinococcus multilocularis lamin dm0 0.0146 0.3796 0.3783
Schistosoma mansoni alpha-glucosidase 0.015 0.3925 0.4448
Loa Loa (eye worm) hypothetical protein 0.0043 0.0715 0.0854
Plasmodium vivax ataxin-2 like protein, putative 0.0027 0.0253 0.1121
Loa Loa (eye worm) hypothetical protein 0.0068 0.1458 0.1742
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0203 0.5504 0.5494
Echinococcus granulosus histone lysine methyltransferase setb 0.0049 0.091 0.089
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0036 0.0513 0.0493
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0031 0.0361 0.0341
Loa Loa (eye worm) intermediate filament protein 0.0146 0.3796 0.4533
Loa Loa (eye worm) PHD-finger family protein 0.0021 0.0053 0.0063
Echinococcus granulosus histone acetyltransferase MYST2 0.0059 0.1186 0.1168
Toxoplasma gondii Erv1 / Alr family protein 0.0036 0.0514 0.1299
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0025 0.0192 0.1494
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.006 0.1228 0.121
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.0192 0.0229
Loa Loa (eye worm) hypothetical protein 0.0094 0.226 0.2698
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0052 0.0986 0.0982
Echinococcus granulosus geminin 0.0184 0.4951 0.494
Loa Loa (eye worm) hypothetical protein 0.0068 0.1458 0.1742
Echinococcus granulosus fetal alzheimer antigen falz 0.0023 0.0111 0.0089
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0203 0.5504 0.5494
Echinococcus multilocularis survival motor neuron protein 1 0.0271 0.7554 0.7549
Brugia malayi Probable ClpP-like protease 0.0094 0.226 0.2536
Echinococcus granulosus cytoplasmic intermediate filament protein 0.007 0.1538 0.152
Plasmodium vivax SET domain protein, putative 0.0032 0.0397 0.1755
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0023 0.0111 0.0089
Leishmania major alpha glucosidase II subunit, putative 0.0039 0.0591 1
Onchocerca volvulus 0.0146 0.3796 0.523
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.007 0.1538 0.152
Echinococcus granulosus SAM and MBT domain containing protein 0.0051 0.0973 0.0954
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0052 0.0986 0.1099
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0051 0.0973 0.1133
Loa Loa (eye worm) MBCTL1 0.0059 0.1186 0.1417
Echinococcus granulosus peptidase Clp S14 family 0.0062 0.1286 0.1267
Echinococcus multilocularis SAM and MBT domain containing protein 0.0051 0.0973 0.0954
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.0192 0.0229
Schistosoma mansoni hypothetical protein 0.0184 0.4951 0.5616
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0032 0.0397 0.0428
Echinococcus multilocularis peptidase Clp (S14 family) 0.0062 0.1286 0.1267
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0094 0.226 1
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0039 0.0591 1
Plasmodium falciparum FAD-linked sulfhydryl oxidase ERV1, putative 0.0036 0.0514 0.2274
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0033 0.0406 0.1799
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0052 0.0986 0.0967
Onchocerca volvulus 0.0146 0.3796 0.523
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0025 0.0192 0.0229
Schistosoma mansoni peptidase Clp (S14 family) 0.0094 0.226 0.255
Schistosoma mansoni lamin 0.0146 0.3796 0.4301
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.006 0.1228 0.121
Loa Loa (eye worm) hypothetical protein 0.0027 0.0253 0.0303
Trypanosoma cruzi hypothetical protein, conserved 0.0039 0.0591 1
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0033 0.0406 0.1799
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0025 0.0192 0.0229
Echinococcus granulosus polycomb protein SCMH1 0.0051 0.0973 0.0954
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0049 0.091 0.089
Onchocerca volvulus 0.0101 0.2451 0.3278
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0094 0.226 0.5
Loa Loa (eye worm) hypothetical protein 0.0059 0.1186 0.1417
Trichomonas vaginalis set domain proteins, putative 0.0256 0.7083 0.8342
Brugia malayi hypothetical protein 0.0027 0.0253 0.0087
Schistosoma mansoni sex comb on midleg homolog 0.0051 0.0973 0.1084
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0025 0.0192 0.0229
Trichomonas vaginalis glutaminase, putative 0.0299 0.8374 1
Schistosoma mansoni hypothetical protein 0.0184 0.4951 0.5616
Brugia malayi mbt repeat family protein 0.0051 0.0973 0.0966
Loa Loa (eye worm) hepatopoietin HPO2 0.0036 0.0514 0.0614
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0094 0.226 1
Loa Loa (eye worm) hypothetical protein 0.0039 0.0587 0.0701
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0059 0.1186 0.1168
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0094 0.226 1
Onchocerca volvulus 0.0032 0.0397 0.0297
Schistosoma mansoni alpha glucosidase 0.0039 0.0591 0.0649
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0225 0.6155 0.735
Loa Loa (eye worm) hypothetical protein 0.0271 0.7554 0.9021
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0055 0.1089 0.1107
Echinococcus granulosus lamin dm0 0.0146 0.3796 0.3783
Loa Loa (eye worm) hypothetical protein 0.0052 0.0979 0.1169
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0094 0.226 1
Loa Loa (eye worm) hypothetical protein 0.0049 0.091 0.1086
Brugia malayi glutaminase DH11.1 0.0299 0.8374 1
Brugia malayi Bromodomain containing protein 0.0038 0.0585 0.0492
Brugia malayi Glycosyl hydrolases family 31 protein 0.0039 0.0591 0.0499
Loa Loa (eye worm) hypothetical protein 0.0025 0.0192 0.0229
Schistosoma mansoni hypothetical protein 0.0313 0.8798 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0049 0.091 0.1012
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0052 0.0986 0.0967
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0032 0.0397 0.0428
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.0192 0.0229
Schistosoma mansoni cellular tumor antigen P53 0.0052 0.0979 0.1091
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0036 0.0513 0.0493
Onchocerca volvulus 0.0052 0.0979 0.1142
Echinococcus multilocularis geminin 0.0184 0.4951 0.494
Trypanosoma cruzi hypothetical protein, conserved 0.0039 0.0591 1
Brugia malayi AMP-binding enzyme family protein 0.0025 0.0192 0.0012
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0174 0.4652 0.5555
Leishmania major hypothetical protein, conserved 0.0036 0.0514 0.8074
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0059 0.1186 0.1168
Loa Loa (eye worm) hypothetical protein 0.0051 0.0973 0.1162
Schistosoma mansoni hypothetical protein 0.0055 0.1089 0.1216
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0094 0.226 1
Loa Loa (eye worm) glutaminase 2 0.0299 0.8374 1
Schistosoma mansoni lamin 0.0146 0.3796 0.4301
Echinococcus multilocularis lysosomal alpha glucosidase 0.0174 0.4652 0.4641
Onchocerca volvulus 0.0256 0.7083 1
Loa Loa (eye worm) mbt repeat family protein 0.0051 0.0973 0.1162
Brugia malayi AMP-binding enzyme family protein 0.0025 0.0192 0.0012
Trypanosoma brucei ERV/ALR sulfhydryl oxidase domain-containing protein 0.0036 0.0514 0.7724
Loa Loa (eye worm) hypothetical protein 0.0146 0.3796 0.4533
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0094 0.226 1
Plasmodium falciparum ataxin-2 like protein, putative 0.0027 0.0253 0.1121
Trypanosoma cruzi ERV/ALR sulfhydryl oxidase domain-containing protein 0.0036 0.0514 0.7724

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.4147 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) 19.9526 uM PubChem BioAssay. qHTS Assay for Activators of ClpP. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 29.0929 uM PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125] ChEMBL. No reference
Potency (functional) 35.4813 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b: Cytotox Counterscreen. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588855, AID588860] ChEMBL. No reference
Potency (functional) 37.933 uM PUBCHEM_BIOASSAY: qHTS profiling assay for firefly luciferase inhibitor/activator using purified enzyme and Km concentrations of substrates (counterscreen for miR-21 project). (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2288, AID2289, AID2598, AID411] ChEMBL. No reference
Potency (functional) = 112.2018 um PUBCHEM_BIOASSAY: qHTS Inhibitors of AmpC Beta-Lactamase (assay with detergent). (Class of assay: confirmatory) [Related pubchem assays: 1002 (Confirmation Concentration-Response Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent)), 585 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay without detergent) - a screen old NIH MLSMR collection), 584 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay with detergent) - a screen of the old NIH MLSMR collection), 1003 (Confirmation Cuvette-Based Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent))] 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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