Detailed information for compound 353026

Basic information

Technical information
  • TDR Targets ID: 353026
  • Name: N-[2-(2-amino-3H-imidazol-4-yl)ethyl]-3-[4-(3 -aminopropoxy)-3,5-dibromophenyl]-2-hydroxyim inopropanamide
  • MW: 518.203 | Formula: C17H22Br2N6O3
  • H donors: 5 H acceptors: 3 LogP: 2.38 Rotable bonds: 11
    Rule of 5 violations (Lipinski): 2
  • SMILES: NCCCOc1c(Br)cc(cc1Br)C/C(=N/O)/C(=O)NCCc1c[nH]c(n1)N
  • InChi: 1S/C17H22Br2N6O3/c18-12-6-10(7-13(19)15(12)28-5-1-3-20)8-14(25-27)16(26)22-4-2-11-9-23-17(21)24-11/h6-7,9,27H,1-5,8,20H2,(H,22,26)(H3,21,23,24)/b25-14-
  • InChiKey: VZDKEGKTDBWXJY-QFEZKATASA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-[2-(2-amino-3H-imidazol-4-yl)ethyl]-3-[4-(3-aminopropoxy)-3,5-dibromo-phenyl]-2-hydroxyimino-propanamide
  • N-[2-(2-amino-3H-imidazol-4-yl)ethyl]-3-[4-(3-aminopropoxy)-3,5-dibromo-phenyl]-2-hydroximino-propionamide

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
Trypanosoma cruzi PAB1-binding protein , putative 0.0052 0.0102 0.0751
Mycobacterium leprae conserved hypothetical protein 0.0261 0.1299 0.1264
Schistosoma mansoni adapter molecule crk 0.0068 0.0194 0.0373
Echinococcus multilocularis serotonin receptor 0.012 0.0491 0.0491
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0331 0.1703 0.3266
Entamoeba histolytica N-acetylglucosaminyl-phosphatidylinositol de-N-acetylase, putative 0.0055 0.0119 0.0816
Echinococcus granulosus tyrosine protein kinase Fps85D 0.0055 0.0117 0.0225
Echinococcus multilocularis fibroblast growth factor receptor 4 0.0424 0.2234 0.2234
Loa Loa (eye worm) hypothetical protein 0.0123 0.0507 0.0972
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0123 0.0507 0.0972
Brugia malayi hypothetical protein 0.0232 0.1132 0.2172
Echinococcus multilocularis neutral alpha glucosidase AB 0.0035 0.0005 0.0005
Echinococcus granulosus tyrosine kinase 0.0055 0.0117 0.0225
Brugia malayi SH2 domain containing protein 0.0055 0.0117 0.0225
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.0357 0.1854 0.3556
Echinococcus multilocularis tyrosine protein kinase shark 0.0055 0.0117 0.0117
Echinococcus granulosus c src tyrosine kinase 0.0089 0.0311 0.0597
Mycobacterium ulcerans esterase/lipase LipP 0.0261 0.1299 0.1264
Schistosoma mansoni hypothetical protein 0.0271 0.1358 0.2605
Schistosoma mansoni hypothetical protein 0.0047 0.0072 0.0139
Schistosoma mansoni survival motor neuron protein 0.0047 0.0072 0.0139
Loa Loa (eye worm) hypothetical protein 0.0261 0.1299 0.2491
Loa Loa (eye worm) hypothetical protein 0.0179 0.0828 0.1587
Echinococcus granulosus tyrosine protein kinase Src42A 0.0357 0.1854 0.3556
Onchocerca volvulus 0.0055 0.0117 0.0217
Echinococcus multilocularis tyrosine protein kinase Fgr 0.0357 0.1854 0.1854
Echinococcus granulosus twitchin 0.0036 0.0007 0.0014
Trichomonas vaginalis esterase, putative 0.0261 0.1299 0.2396
Onchocerca volvulus 0.0055 0.0117 0.0217
Onchocerca volvulus 0.0055 0.0117 0.0217
Echinococcus multilocularis lysosomal alpha glucosidase 0.016 0.072 0.072
Echinococcus granulosus tyrosine protein kinase ABL1 0.0055 0.0117 0.0225
Loa Loa (eye worm) TK/ABL protein kinase 0.0055 0.0117 0.0225
Entamoeba histolytica hypothetical protein 0.0271 0.1358 0.9299
Schistosoma mansoni proto-oncogene tyrosine-protein kinase abl1 0.0068 0.0194 0.0373
Loa Loa (eye worm) TK/FER protein kinase 0.0055 0.0117 0.0225
Schistosoma mansoni alpha-glucosidase 0.0138 0.0592 0.1135
Brugia malayi Glycosyl hydrolases family 31 protein 0.0035 0.0005 0.0009
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.0357 0.1854 0.1854
Schistosoma mansoni cell adhesion molecule 0.0039 0.0027 0.0051
Brugia malayi Protein kinase domain containing protein 0.0055 0.0117 0.0225
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0035 0.0005 0.0032
Echinococcus granulosus epidermal growth factor receptor 0.0513 0.2749 0.5273
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0047 0.0072 0.0139
Echinococcus granulosus lysosomal alpha glucosidase 0.016 0.072 0.138
Mycobacterium ulcerans lipase LipD 0.0261 0.1299 0.1264
Echinococcus granulosus epidermal growth factor receptor 0.0942 0.5214 1
Schistosoma mansoni biogenic amine (5HT) receptor 0.012 0.0491 0.0942
Brugia malayi SRC-1 0.0357 0.1854 0.3556
Brugia malayi hypothetical protein 0.0052 0.0102 0.0195
Brugia malayi Protein kinase domain containing protein 0.0055 0.0117 0.0225
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0331 0.1703 0.3266
Brugia malayi Protein kinase domain containing protein 0.0055 0.0117 0.0225
Echinococcus granulosus tyrosine protein kinase Blk 0.0324 0.166 0.3184
Loa Loa (eye worm) TK/FER protein kinase 0.0055 0.0117 0.0225
Loa Loa (eye worm) hypothetical protein 0.0261 0.1299 0.2491
Mycobacterium ulcerans mycothiol conjugate amidase Mca 0.168 0.945 1
Entamoeba histolytica hypothetical protein 0.0271 0.1358 0.9299
Echinococcus granulosus geminin 0.0902 0.4981 0.9553
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0357 0.1854 0.1854
Loa Loa (eye worm) TK/FER protein kinase 0.0055 0.0117 0.0225
Loa Loa (eye worm) hypothetical protein 0.012 0.0491 0.0942
Loa Loa (eye worm) transcription factor SMAD2 0.0246 0.1214 0.2328
Echinococcus granulosus neuroglian 0.0036 0.0007 0.0014
Schistosoma mansoni tyrosine kinase 0.0357 0.1854 0.3556
Echinococcus granulosus basic fibroblast growth factor receptor 1 A 0.0424 0.2234 0.4285
Trypanosoma cruzi N-Acetyl-D-glucosaminylphosphatidylinositol de-N-acetylase, putative 0.0055 0.0119 0.0885
Toxoplasma gondii ABC1 family protein 0.0261 0.1299 1
Onchocerca volvulus 0.0055 0.0117 0.0217
Echinococcus granulosus insulin growth factor 1 receptor beta 0.0311 0.159 0.3049
Brugia malayi Pre-SET motif family protein 0.0123 0.0507 0.0972
Brugia malayi hypothetical protein 0.0055 0.0117 0.0225
Mycobacterium ulcerans hypothetical protein 0.0261 0.1299 0.1264
Loa Loa (eye worm) SRC-1 0.0357 0.1854 0.3556
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.0357 0.1854 0.3556
Trypanosoma cruzi PAB1-binding protein , putative 0.0052 0.0102 0.0751
Mycobacterium leprae Probable lipase LipE 0.0261 0.1299 0.1264
Loa Loa (eye worm) hypothetical protein 0.0261 0.1299 0.2491
Plasmodium vivax hypothetical protein, conserved 0.0261 0.1299 1
Echinococcus granulosus biogenic amine 5HT receptor 0.012 0.0491 0.0942
Schistosoma mansoni hypothetical protein 0.0083 0.0276 0.053
Echinococcus granulosus tyrosine kinase|tyrosine protein kinase Fyn 0.0324 0.166 0.3184
Loa Loa (eye worm) hypothetical protein 0.0261 0.1303 0.2499
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0331 0.1703 0.3266
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0261 0.1299 0.2491
Schistosoma mansoni nephrin 0.0036 0.0007 0.0014
Echinococcus granulosus roundabout 2 0.0051 0.0096 0.0185
Loa Loa (eye worm) TK/FER protein kinase 0.0055 0.0117 0.0225
Loa Loa (eye worm) TK protein kinase 0.0324 0.166 0.3184
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0035 0.0005 0.0032
Echinococcus granulosus growth factor receptor bound protein 2 0.0068 0.0194 0.0373
Brugia malayi beta-lactamase 0.0261 0.1299 0.2491
Echinococcus multilocularis serotonin receptor 0.012 0.0491 0.0491
Echinococcus multilocularis tyrosine protein kinase Abl 0.0089 0.0311 0.0311
Brugia malayi Protein kinase domain containing protein 0.0311 0.159 0.3049
Mycobacterium tuberculosis Possible penicillin-binding protein 0.1666 0.937 1
Schistosoma mansoni hypothetical protein 0.0902 0.4981 0.9553
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0123 0.0507 0.0507
Echinococcus multilocularis epidermal growth factor receptor 0.0513 0.2749 0.2749
Brugia malayi Glycosyl hydrolases family 31 protein 0.016 0.072 0.138
Toxoplasma gondii N-acetylglucosaminylphosphatidylinositol deacetylase 0.0055 0.0119 0.0885
Brugia malayi MH2 domain containing protein 0.0246 0.1214 0.2328
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.0357 0.1854 0.1854
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0123 0.0507 0.0972
Echinococcus multilocularis insulin receptor 0.0311 0.159 0.159
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0123 0.0507 0.0507
Echinococcus granulosus fibroblast growth factor receptor 4 0.0424 0.2234 0.4285
Echinococcus multilocularis lysosomal alpha glucosidase 0.016 0.072 0.072
Schistosoma mansoni hypothetical protein 0.0902 0.4981 0.9553
Schistosoma mansoni tyrosine kinase 0.0942 0.5214 1
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0083 0.0276 0.053
Loa Loa (eye worm) hypothetical protein 0.0051 0.0096 0.0185
Entamoeba histolytica hypothetical protein 0.0271 0.1358 0.9299
Brugia malayi Latrophilin receptor protein 2 0.0083 0.0276 0.053
Schistosoma mansoni tyrosine kinase 0.0357 0.1854 0.3556
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0261 0.1299 0.1264
Brugia malayi Furin-like cysteine rich region family protein 0.0942 0.5214 1
Loa Loa (eye worm) TK/EGFR protein kinase 0.0942 0.5214 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0123 0.0507 0.0972
Brugia malayi hypothetical protein 0.0271 0.1358 0.2605
Echinococcus granulosus tyrosine protein kinase HCK 0.0289 0.1461 0.2802
Mycobacterium leprae Mycothiol conjugate amidase Mca (Mycothiol S-conjugate amidase) 0.168 0.945 1
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0261 0.1299 0.1275
Echinococcus multilocularis tyrosine protein kinase Fps85D 0.0055 0.0117 0.0117
Echinococcus multilocularis epidermal growth factor receptor 0.0942 0.5214 0.5214
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0261 0.1299 0.2491
Trypanosoma brucei N-acetyl-D-glucosaminylphosphatidylinositol de-N-acetylase 0.0055 0.0119 0.0885
Loa Loa (eye worm) hypothetical protein 0.0051 0.0096 0.0185
Trypanosoma brucei hypothetical protein, conserved 0.0261 0.1299 1
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0303 0.1543 0.1543
Brugia malayi Tyrosine-protein kinase abl-1 0.0089 0.0311 0.0597
Loa Loa (eye worm) phosphatidylinositol glycan anchor biosynthesis protein 0.0055 0.0119 0.0229
Trichomonas vaginalis D-aminoacylase, putative 0.0261 0.1299 0.2396
Echinococcus granulosus histone lysine methyltransferase setb 0.0123 0.0507 0.0972
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0271 0.1358 0.2605
Schistosoma mansoni alpha-glucosidase 0.0138 0.0592 0.1135
Entamoeba histolytica protein kinase, putative 0.0289 0.1461 1
Mycobacterium tuberculosis Conserved protein 0.0261 0.1299 0.1275
Trichomonas vaginalis penicillin-binding protein, putative 0.0261 0.1299 0.2396
Entamoeba histolytica glucosamine-6-phosphate isomerase, putative 0.0055 0.0119 0.0816
Mycobacterium tuberculosis Probable lipase LipD 0.0261 0.1299 0.1275
Schistosoma mansoni hypothetical protein 0.0179 0.0828 0.1587
Plasmodium falciparum N-acetylglucosaminylphosphatidylinositol deacetylase, putative 0.0055 0.0119 1
Schistosoma mansoni tyrosine kinase 0.0055 0.0117 0.0225
Schistosoma mansoni tyrosine kinase 0.0493 0.2632 0.5049
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.016 0.072 0.138
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0331 0.1703 0.1703
Echinococcus granulosus N acetylglucosaminyl phosphatidylinositol 0.0055 0.0119 0.0229
Loa Loa (eye worm) hypothetical protein 0.0083 0.0276 0.053
Onchocerca volvulus 0.0093 0.0332 0.0615
Echinococcus multilocularis tyrosine protein kinase Btk29A 0.0089 0.0311 0.0311
Schistosoma mansoni N-acetylglucosaminyl-phosphatidylinositol de-n-acetylase 0.0055 0.0119 0.0229
Onchocerca volvulus 0.0123 0.0507 0.0938
Leishmania major hypothetical protein, conserved 0.0052 0.0102 0.0751
Schistosoma mansoni tyrosine kinase 0.0048 0.0077 0.0147
Loa Loa (eye worm) latrophilin receptor protein 2 0.0083 0.0276 0.053
Schistosoma mansoni tyrosine kinase 0.0089 0.0311 0.0597
Loa Loa (eye worm) hypothetical protein 0.0261 0.1299 0.2491
Brugia malayi Calcitonin receptor-like protein seb-1 0.0261 0.1303 0.2499
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0083 0.0276 0.053
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0261 0.1299 0.1275
Brugia malayi Immunoglobulin I-set domain containing protein 0.0436 0.2304 0.4419
Trichomonas vaginalis penicillin-binding protein, putative 0.0261 0.1299 0.2396
Mycobacterium tuberculosis Probable hydrolase 0.0261 0.1299 0.1275
Mycobacterium tuberculosis Conserved protein 0.0261 0.1299 0.1275
Echinococcus granulosus neutral alpha glucosidase AB 0.0035 0.0005 0.0009
Echinococcus granulosus tyrosine kinase 0.0324 0.166 0.3184
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0261 0.1299 0.2491
Echinococcus granulosus neurotracting:lsamp:neurotrimin:obcam 0.0039 0.0027 0.0051
Echinococcus multilocularis tyrosine protein kinase HCK 0.0289 0.1461 0.1461
Schistosoma mansoni tyrosine kinase 0.0424 0.2234 0.4285
Trypanosoma brucei PAB1-binding protein , putative 0.0052 0.0102 0.0751
Onchocerca volvulus 0.0261 0.1299 0.2403
Brugia malayi Protein kinase domain containing protein 0.0055 0.0117 0.0225
Brugia malayi beta-lactamase family protein 0.0261 0.1299 0.2491
Brugia malayi beta-lactamase family protein 0.0261 0.1299 0.2491
Trypanosoma cruzi hypothetical protein, conserved 0.0261 0.1299 1
Trichomonas vaginalis D-aminoacylase, putative 0.0261 0.1299 0.2396
Brugia malayi Sex muscle abnormal protein 5 0.0068 0.0194 0.0373
Echinococcus granulosus tyrosine protein kinase Src64B 0.0357 0.1854 0.3556
Schistosoma mansoni tyrosine kinase 0.0055 0.0117 0.0225
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0357 0.1854 0.1854
Entamoeba histolytica SH2-protein kinase domain containing protein 0.0055 0.0117 0.0802
Echinococcus multilocularis c src tyrosine kinase 0.0089 0.0311 0.0311
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0083 0.0276 0.0276
Echinococcus multilocularis insulin growth factor 1 receptor beta 0.0311 0.159 0.159
Schistosoma mansoni nck2/grb4 0.0068 0.0194 0.0373
Brugia malayi Pre-SET motif family protein 0.0857 0.4724 0.906
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0857 0.4724 0.906
Trichomonas vaginalis D-aminoacylase, putative 0.0261 0.1299 0.2396
Echinococcus multilocularis N acetylglucosaminyl phosphatidylinositol 0.0055 0.0119 0.0119
Plasmodium vivax N-acetylglucosaminylphosphatidylinositol deacetylase, putative 0.0055 0.0119 0.0145
Brugia malayi Immunoglobulin I-set domain containing protein 0.006 0.0144 0.0276
Echinococcus granulosus beta LACTamase domain containing family member 0.0261 0.1299 0.2491
Echinococcus multilocularis tyrosine protein kinase Blk 0.0324 0.166 0.166
Echinococcus granulosus NCK adaptor protein 0.0068 0.0194 0.0373
Toxoplasma gondii LsmAD domain-containing protein 0.0052 0.0102 0.0751
Loa Loa (eye worm) TK protein kinase 0.0289 0.1461 0.2802
Echinococcus multilocularis roundabout 2 0.0051 0.0096 0.0096
Brugia malayi SH2 domain containing protein 0.0055 0.0117 0.0225
Echinococcus multilocularis 0.0287 0.1449 0.1449
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0331 0.1703 0.3266
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0331 0.1703 0.3266
Loa Loa (eye worm) TK/FER protein kinase 0.0055 0.0117 0.0225
Mycobacterium tuberculosis Probable lipase LipE 0.0261 0.1299 0.1275
Loa Loa (eye worm) MH2 domain-containing protein 0.0246 0.1214 0.2328
Loa Loa (eye worm) hypothetical protein 0.0068 0.0194 0.0373
Brugia malayi latrophilin 2 splice variant baaae 0.0179 0.0828 0.1587
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0123 0.0507 0.0972
Loa Loa (eye worm) TK/FER protein kinase 0.0055 0.0117 0.0225
Schistosoma mansoni growth factor receptor-bound protein 0.0068 0.0194 0.0373
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0331 0.1703 0.1703
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.0357 0.1854 0.1854
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0331 0.1703 0.3266
Echinococcus multilocularis tyrosine protein kinase Srms 0.0324 0.166 0.166
Schistosoma mansoni tyrosine kinase 0.0311 0.159 0.3049
Echinococcus granulosus tyrosine protein kinase shark 0.0055 0.0117 0.0225
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0331 0.1703 0.3266
Onchocerca volvulus 0.0975 0.5404 1
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0261 0.1299 0.1275
Echinococcus multilocularis tyrosine protein kinase ABL1 0.0055 0.0117 0.0117
Trichomonas vaginalis set domain proteins, putative 0.0975 0.5404 1
Schistosoma mansoni tyrosine kinase 0.0513 0.2749 0.5273
Entamoeba histolytica hypothetical protein 0.0271 0.1358 0.9299
Echinococcus multilocularis basic fibroblast growth factor receptor 1 A 0.0424 0.2234 0.2234
Brugia malayi Variant SH3 domain containing protein 0.0068 0.0194 0.0373
Schistosoma mansoni hypothetical protein 0.0083 0.0276 0.053
Brugia malayi Protein kinase domain containing protein 0.0055 0.0117 0.0225
Loa Loa (eye worm) TK/KIN16 protein kinase 0.006 0.0144 0.0276
Brugia malayi protein-tyrosine kinase 0.0324 0.166 0.3184
Schistosoma mansoni tyrosine kinase 0.0493 0.2632 0.5049
Trypanosoma cruzi hypothetical protein, conserved 0.0261 0.1299 1
Brugia malayi Uncharacterized LmbE-like protein, COG2120 containing protein 0.0055 0.0119 0.0229
Echinococcus granulosus tyrosine protein kinase Lyn 0.0357 0.1854 0.3556
Schistosoma mansoni alpha glucosidase 0.0035 0.0005 0.0009
Loa Loa (eye worm) hypothetical protein 0.0261 0.1299 0.2491
Loa Loa (eye worm) TK/FER protein kinase 0.0055 0.0117 0.0225
Echinococcus granulosus tyrosine protein kinase Srms 0.0055 0.0117 0.0225
Mycobacterium ulcerans beta-lactamase 0.0261 0.1299 0.1264
Loa Loa (eye worm) TK/INSR protein kinase 0.0311 0.159 0.3049
Schistosoma mansoni tyrosine kinase 0.0513 0.2749 0.5273
Schistosoma mansoni transcription factor LCR-F1 0.0271 0.1358 0.2605
Loa Loa (eye worm) hypothetical protein 0.0232 0.1132 0.2172
Loa Loa (eye worm) hypothetical protein 0.0052 0.0102 0.0195
Echinococcus granulosus GPCR family 2 0.0083 0.0276 0.053
Schistosoma mansoni hypothetical protein 0.0083 0.0276 0.053
Trichomonas vaginalis glucosamine-6-phosphate isomerase, putative 0.0055 0.0119 0.0212
Loa Loa (eye worm) beta-lactamase 0.0261 0.1299 0.2491
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0271 0.1358 0.1358
Mycobacterium tuberculosis Probable esterase LipL 0.0261 0.1299 0.1275
Echinococcus granulosus insulin receptor 0.0311 0.159 0.3049
Echinococcus multilocularis beta LACTamase domain containing family member 0.0261 0.1299 0.1299
Echinococcus multilocularis GPCR, family 2 0.0083 0.0276 0.0276
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0357 0.1854 0.1854
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0261 0.1303 0.2499
Echinococcus multilocularis survival motor neuron protein 1 0.0232 0.1132 0.1132
Schistosoma mansoni tyrosine kinase 0.0493 0.2632 0.5049
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0035 0.0005 0.0009
Echinococcus multilocularis tyrosine protein kinase Src64B 0.0357 0.1854 0.1854
Echinococcus granulosus tyrosine protein kinase Fyn 0.0357 0.1854 0.3556
Onchocerca volvulus 0.0261 0.1299 0.2403
Loa Loa (eye worm) hypothetical protein 0.0039 0.0027 0.0051
Mycobacterium tuberculosis Mycothiol conjugate amidase Mca (mycothiol S-conjugate amidase) 0.1624 0.9131 0.9742
Loa Loa (eye worm) sex muscle abnormal protein 5 0.0068 0.0194 0.0373
Echinococcus multilocularis growth factor receptor bound protein 2 0.0068 0.0194 0.0194
Mycobacterium tuberculosis Conserved protein 0.0261 0.1299 0.1275
Schistosoma mansoni tyrosine kinase 0.0089 0.0311 0.0597
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0118 0.0481 0.0922
Echinococcus granulosus tyrosine protein kinase Fyn 0.0357 0.1854 0.3556
Schistosoma mansoni serine/threonine protein kinase 0.0054 0.0112 0.0215
Leishmania major hypothetical protein, conserved 0.0261 0.1299 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0261 0.1299 0.2491
Brugia malayi Variant SH3 domain containing protein 0.0068 0.0194 0.0373
Loa Loa (eye worm) TK/FER protein kinase 0.0055 0.0117 0.0225
Onchocerca volvulus 0.0261 0.1299 0.2403
Loa Loa (eye worm) variant SH3 domain-containing protein 0.0068 0.0194 0.0373
Leishmania major N-acetyl-D-acetylglucosaminylphosphatidylinositol deacetylase 0.0055 0.0119 0.0885
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0357 0.1854 0.1854
Onchocerca volvulus 0.0055 0.0117 0.0217
Echinococcus multilocularis neuroglian 0.0036 0.0007 0.0007
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0083 0.0276 0.0276
Loa Loa (eye worm) TK/FER protein kinase 0.0055 0.0117 0.0225
Schistosoma mansoni hypothetical protein 0.0083 0.0276 0.053
Echinococcus granulosus melanoma receptor tyrosine protein kinase 0.0513 0.2749 0.5273
Plasmodium vivax SET domain protein, putative 0.0123 0.0507 0.3385
Loa Loa (eye worm) hypothetical protein 0.012 0.0491 0.0942
Loa Loa (eye worm) TK protein kinase 0.0436 0.2304 0.4419
Schistosoma mansoni tyrosine kinase 0.0311 0.159 0.3049
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0083 0.0276 0.053
Echinococcus multilocularis tyrosine kinase 0.0055 0.0117 0.0117
Echinococcus multilocularis NCK adaptor protein 0.0068 0.0194 0.0194
Echinococcus multilocularis geminin 0.0902 0.4981 0.4981
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0324 0.166 0.166
Schistosoma mansoni growth factor receptor-bound protein 0.0068 0.0194 0.0373
Echinococcus granulosus survival motor neuron protein 1 0.0232 0.1132 0.2172
Onchocerca volvulus 0.0055 0.0117 0.0217
Schistosoma mansoni proto-oncogene tyrosine-protein kinase src 0.0089 0.0311 0.0597
Giardia lamblia Glucosamine-6-phosphate isomerase, putative 0.0055 0.0119 0.5
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0123 0.0507 0.3882
Loa Loa (eye worm) TK/FER protein kinase 0.0055 0.0117 0.0225
Echinococcus granulosus tyrosine protein kinase Btk29A 0.0089 0.0311 0.0597
Loa Loa (eye worm) hypothetical protein 0.0055 0.0117 0.0225
Echinococcus granulosus tyrosine protein kinase Fyn 0.0357 0.1854 0.3556
Onchocerca volvulus 0.0047 0.0072 0.0134
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0261 0.1303 0.2499
Echinococcus granulosus tyrosine protein kinase Src42A 0.0303 0.1543 0.2959
Loa Loa (eye worm) hypothetical protein 0.0261 0.1299 0.2491
Trypanosoma cruzi N-Acetyl-D-glucosaminylphosphatidylinositol de-N-acetylase, putative 0.0055 0.0119 0.0885

Activities

Activity type Activity value Assay description Source Reference
GI50 (functional) = 4.7 uM Antiproliferative activity against mouse L1210 leukemia cell line by MTS assay ChEMBL. 16539395
GI50 (functional) = 4.7 uM Antiproliferative activity against mouse L1210 leukemia cell line by MTS assay ChEMBL. 16539395
GI50 (functional) > 50 uM Antiproliferative activity against human 2008 ovarian carcinoma cells by MTS assay ChEMBL. 16539395
GI50 (functional) > 50 uM Antiproliferative activity against human MDA-MB231 breast carcinoma cells by MTS assay ChEMBL. 16539395
GI50 (functional) > 50 uM Antiproliferative activity against human HT29 colon carcinoma cells by MTS assay ChEMBL. 16539395
GI50 (functional) > 50 uM Antiproliferative activity against human PC3 prostate carcinoma cells by MTS assay ChEMBL. 16539395
GI50 (functional) > 50 uM Antiproliferative activity against human 2008 ovarian carcinoma cells by MTS assay ChEMBL. 16539395
GI50 (functional) > 50 uM Antiproliferative activity against human MDA-MB231 breast carcinoma cells by MTS assay ChEMBL. 16539395
GI50 (functional) > 50 uM Antiproliferative activity against human HT29 colon carcinoma cells by MTS assay ChEMBL. 16539395
GI50 (functional) > 50 uM Antiproliferative activity against human PC3 prostate carcinoma cells by MTS assay ChEMBL. 16539395
IC50 (binding) = 42 uM Inhibition of MT-stimulated ATPase activity of rat cytoplasmic dynein heavy chain motor domain ChEMBL. 16539395
IC50 (binding) = 42 uM Inhibition of MT-stimulated ATPase activity of rat cytoplasmic dynein heavy chain motor domain ChEMBL. 16539395

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

1 literature reference was collected for this gene.

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