Detailed information for compound 1102625

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 410.508 | Formula: C27H26N2O2
  • H donors: 2 H acceptors: 2 LogP: 5.74 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: Oc1cccc(c1)c1[nH]c2ccc(cc2c(=O)c1Cc1ccccc1)N1CCCCC1
  • InChi: 1S/C27H26N2O2/c30-22-11-7-10-20(17-22)26-24(16-19-8-3-1-4-9-19)27(31)23-18-21(12-13-25(23)28-26)29-14-5-2-6-15-29/h1,3-4,7-13,17-18,30H,2,5-6,14-16H2,(H,28,31)
  • InChiKey: FVSURJVLCNDVRZ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens kinesin family member 11 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus granulosus kinesin family 1 Get druggable targets OG5_128460 All targets in OG5_128460
Cryptosporidium hominis kinesin-like boursin Get druggable targets OG5_128460 All targets in OG5_128460
Entamoeba histolytica kinesin, putative Get druggable targets OG5_128460 All targets in OG5_128460
Candida albicans kinesin motor domain protein similar to S. cerevisiae KIP1 (YBL063W) microtubule motor complex protein Get druggable targets OG5_128460 All targets in OG5_128460
Schistosoma mansoni kinesin eg-5 Get druggable targets OG5_128460 All targets in OG5_128460
Plasmodium yoelii Kinesin motor domain, putative Get druggable targets OG5_128460 All targets in OG5_128460
Loa Loa (eye worm) kinesin-like protein KLP2 Get druggable targets OG5_128460 All targets in OG5_128460
Plasmodium falciparum kinesin-5 Get druggable targets OG5_128460 All targets in OG5_128460
Plasmodium vivax kinesin-5 Get druggable targets OG5_128460 All targets in OG5_128460
Giardia lamblia Kinesin-5 Get druggable targets OG5_128460 All targets in OG5_128460
Toxoplasma gondii kinesin motor domain-containing protein Get druggable targets OG5_128460 All targets in OG5_128460
Neospora caninum hypothetical protein Get druggable targets OG5_128460 All targets in OG5_128460
Plasmodium knowlesi kinesin-5, putative Get druggable targets OG5_128460 All targets in OG5_128460
Echinococcus multilocularis kinesin family 1 Get druggable targets OG5_128460 All targets in OG5_128460
Schistosoma japonicum ko:K10398 kinesin family member 11, putative Get druggable targets OG5_128460 All targets in OG5_128460
Cryptosporidium parvum kinesin-like boursin, putative Get druggable targets OG5_128460 All targets in OG5_128460
Candida albicans kinesin motor domain protein similar to S. cerevisiae KIP1 (YBL063W) microtubule motor complex protein Get druggable targets OG5_128460 All targets in OG5_128460
Brugia malayi Kinesin motor domain containing protein Get druggable targets OG5_128460 All targets in OG5_128460
Plasmodium berghei kinesin-5, putative Get druggable targets OG5_128460 All targets in OG5_128460
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
Loa Loa (eye worm) matrixin family protein 0.0054 0.0577 0.302
Trichomonas vaginalis penicillin-binding protein, putative 0.0076 0.0877 0.7327
Loa Loa (eye worm) hypothetical protein 0.0051 0.0538 0.2816
Schistosoma mansoni cpg binding protein 0.0029 0.0226 0.0167
Schistosoma mansoni hypothetical protein 0.0031 0.0257 0.0197
Trypanosoma cruzi DNA polymerase kappa, putative 0.002 0.01 0.0305
Echinococcus granulosus beta LACTamase domain containing family member 0.0076 0.0877 0.0871
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0015 0.0027 0.0141
Brugia malayi serine/threonine-protein kinase plk-2 0.0097 0.1173 0.613
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.01 0.0738
Plasmodium vivax thioredoxin reductase, putative 0.005 0.0522 0.5621
Echinococcus granulosus PHD finger protein rhinoceros 0.003 0.0241 0.0234
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0031 0.0257 0.1331
Loa Loa (eye worm) hypothetical protein 0.0027 0.0202 0.1056
Loa Loa (eye worm) hypothetical protein 0.0076 0.0877 0.4589
Loa Loa (eye worm) intermediate filament protein 0.0027 0.0202 0.1056
Mycobacterium tuberculosis Probable hydrolase 0.0076 0.0877 0.1251
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0037 0.0341 0.248
Echinococcus granulosus thioredoxin glutathione reductase 0.005 0.0522 0.0516
Mycobacterium ulcerans DNA polymerase IV 0.002 0.01 0.0417
Loa Loa (eye worm) thioredoxin reductase 0.005 0.0522 0.2732
Trichomonas vaginalis inositol monophosphatase, putative 0.0037 0.0341 0.248
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.01 0.0738
Schistosoma mansoni transcription factor LCR-F1 0.0036 0.032 0.0261
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.01 0.0738
Trypanosoma brucei trypanothione reductase 0.005 0.0522 0.4381
Brugia malayi Thioredoxin reductase 0.005 0.0522 0.2722
Loa Loa (eye worm) PHD-finger family protein 0.003 0.0241 0.1261
Treponema pallidum NADH oxidase 0.0017 0.0067 0.5
Mycobacterium tuberculosis Probable lipase LipD 0.0076 0.0877 0.1251
Mycobacterium tuberculosis Probable oxidoreductase 0.0127 0.1593 0.2355
Onchocerca volvulus 0.0076 0.0877 0.7147
Schistosoma mansoni serine/threonine protein kinase 0.0097 0.1173 0.1119
Onchocerca volvulus 0.0029 0.0226 0.0868
Trypanosoma brucei DNA polymerase IV, putative 0.002 0.01 0.0738
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.002 0.01 0.0052
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.003 0.0241 0.0181
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0017 0.0067 0.0006
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0127 0.1593 1
Brugia malayi Matrixin family protein 0.0022 0.0136 0.07
Schistosoma mansoni microtubule-associated protein tau 0.0731 1 1
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0037 0.0341 0.2816
Plasmodium falciparum thioredoxin reductase 0.005 0.0522 1
Loa Loa (eye worm) hypothetical protein 0.0013 0.0007 0.0036
Trichomonas vaginalis CAMK family protein kinase 0.0097 0.1173 1
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0127 0.1593 0.2355
Mycobacterium tuberculosis Conserved hypothetical protein 0.002 0.01 0.0052
Echinococcus multilocularis muscleblind protein 0.015 0.1912 0.1906
Loa Loa (eye worm) hypothetical protein 0.0031 0.0257 0.1343
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0048 0.05 0.2603
Schistosoma mansoni hypothetical protein 0.0411 0.5539 0.5511
Onchocerca volvulus 0.0027 0.0202 0.0632
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0076 0.0877 0.4581
Brugia malayi ImpB/MucB/SamB family protein 0.002 0.01 0.0513
Schistosoma mansoni inositol monophosphatase 0.0037 0.0341 0.0282
Schistosoma mansoni inositol monophosphatase 0.0037 0.0341 0.0282
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0097 0.1173 0.1167
Toxoplasma gondii PHD-finger domain-containing protein 0.003 0.0241 0.2152
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0114 0.1415 0.2081
Brugia malayi Kinesin motor domain containing protein 0.0032 0.0272 0.1413
Toxoplasma gondii kinesin motor domain-containing protein 0.0032 0.0272 0.2537
Plasmodium falciparum phd finger protein, putative 0.003 0.0241 0.3828
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0031 0.0257 0.025
Echinococcus granulosus lysine specific demethylase 5A 0.0038 0.0351 0.0345
Brugia malayi glutathione reductase 0.005 0.0522 0.2722
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0017 0.0067 0.0446
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0037 0.0341 0.3385
Loa Loa (eye worm) hypothetical protein 0.003 0.0241 0.1261
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.002 0.01 0.0305
Brugia malayi ImpB/MucB/SamB family protein 0.002 0.01 0.0513
Echinococcus granulosus dna polymerase eta 0.002 0.01 0.0094
Onchocerca volvulus Alhambra homolog 0.003 0.0241 0.1011
Loa Loa (eye worm) hypothetical protein 0.002 0.01 0.0526
Loa Loa (eye worm) glutathione reductase 0.005 0.0522 0.2732
Giardia lamblia Kinesin-5 0.0032 0.0272 0.1859
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0076 0.0877 0.0821
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0076 0.0877 0.1251
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0076 0.0877 1
Schistosoma mansoni matrix metallopeptidase-7 (M10 family) 0.0022 0.0136 0.0076
Schistosoma mansoni jumonji domain containing protein 0.0078 0.0908 0.0852
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0076 0.0877 0.4589
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0037 0.0341 0.248
Trypanosoma cruzi DNA polymerase eta, putative 0.002 0.01 0.0305
Brugia malayi latrophilin 2 splice variant baaae 0.0067 0.0758 0.3954
Onchocerca volvulus 0.0032 0.0266 0.1254
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0036 0.032 0.0314
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB 0.0033 0.0287 0.034
Loa Loa (eye worm) latrophilin receptor protein 2 0.0031 0.0257 0.1343
Onchocerca volvulus Serine\/threonine kinase homolog 0.0097 0.1173 1
Leishmania major DNA polymerase eta, putative 0.002 0.01 0.0305
Trypanosoma cruzi DNA polymerase kappa, putative 0.002 0.01 0.0305
Echinococcus multilocularis lamin 0.0027 0.0202 0.0195
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0114 0.1415 0.2081
Trypanosoma cruzi hypothetical protein, conserved 0.0076 0.0877 0.7327
Brugia malayi Muscleblind-like protein 0.015 0.1912 1
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.01 0.0738
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0017 0.0067 0.0446
Brugia malayi beta-lactamase family protein 0.0076 0.0877 0.4581
Brugia malayi Calcitonin receptor-like protein seb-1 0.0098 0.1189 0.6215
Loa Loa (eye worm) jmjC domain-containing protein 0.0062 0.0684 0.3578
Plasmodium vivax hypothetical protein, conserved 0.0076 0.0877 1
Loa Loa (eye worm) matrix metalloproteinase 0.0022 0.0136 0.0713
Schistosoma mansoni hypothetical protein 0.0031 0.0257 0.0197
Entamoeba histolytica hypothetical protein 0.0036 0.032 0.2049
Echinococcus multilocularis kinesin family 1 0.0247 0.3268 0.3263
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0061 0.0676 0.0619
Schistosoma mansoni terminal deoxycytidyl transferase 0.002 0.01 0.004
Loa Loa (eye worm) inositol-1 0.0037 0.0341 0.1784
Trichomonas vaginalis CAMK family protein kinase 0.0097 0.1173 1
Schistosoma mansoni kinesin eg-5 0.0032 0.0272 0.0213
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.002 0.01 0.0094
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0036 0.032 0.0314
Schistosoma mansoni hypothetical protein 0.0215 0.282 0.2777
Onchocerca volvulus Matrilysin homolog 0.005 0.0515 0.3655
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.002 0.01 0.0305
Echinococcus granulosus kinesin family 1 0.0247 0.3268 0.3263
Onchocerca volvulus Matrix metalloproteinase homolog 0.005 0.0515 0.3655
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0037 0.0341 0.248
Brugia malayi Matrix metalloprotease, N-terminal domain containing protein 0.0027 0.0204 0.1055
Brugia malayi Matrixin family protein 0.0054 0.0577 0.3011
Schistosoma mansoni hypothetical protein 0.0032 0.0266 0.0207
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0037 0.0341 0.3385
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.01 0.0738
Echinococcus multilocularis jumonji domain containing protein 0.0042 0.0404 0.0397
Trichomonas vaginalis CAMK family protein kinase 0.0097 0.1173 1
Schistosoma mansoni hypothetical protein 0.0067 0.0758 0.0701
Loa Loa (eye worm) matrixin family protein 0.005 0.0515 0.2695
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.05 0.0442
Entamoeba histolytica kinesin, putative 0.0032 0.0272 0.1602
Onchocerca volvulus 0.0076 0.0877 0.7147
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0037 0.0341 0.248
Trichomonas vaginalis CAMK family protein kinase 0.0048 0.0492 0.3847
Brugia malayi CXXC zinc finger family protein 0.0029 0.0226 0.1172
Trypanosoma brucei hypothetical protein, conserved 0.0076 0.0877 0.7446
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.002 0.01 0.0094
Mycobacterium tuberculosis Conserved protein 0.0076 0.0877 0.1251
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0097 0.1173 0.1167
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0031 0.0257 0.025
Schistosoma mansoni hypothetical protein 0.0031 0.0257 0.0197
Schistosoma mansoni cpg binding protein 0.003 0.0249 0.019
Brugia malayi Bromodomain containing protein 0.003 0.0241 0.1249
Trichomonas vaginalis D-aminoacylase, putative 0.0076 0.0877 0.7327
Schistosoma mansoni jumonji/arid domain-containing protein 0.0038 0.0351 0.0293
Echinococcus granulosus intermediate filament protein 0.0027 0.0202 0.0195
Entamoeba histolytica hypothetical protein 0.0036 0.032 0.2049
Mycobacterium tuberculosis Probable esterase LipL 0.0076 0.0877 0.1251
Trypanosoma brucei polo-like protein kinase 0.0097 0.1173 1
Loa Loa (eye worm) hypothetical protein 0.0067 0.0758 0.3962
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0031 0.0257 0.025
Entamoeba histolytica hypothetical protein 0.0036 0.032 0.2049
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0114 0.1415 0.2081
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.0017 0.0067 0.5
Trichomonas vaginalis CAMK family protein kinase 0.0097 0.1173 1
Toxoplasma gondii histone lysine methyltransferase SET1 0.0055 0.0585 0.6396
Echinococcus multilocularis lysine specific demethylase 5A 0.0036 0.0329 0.0322
Echinococcus multilocularis inositol monophosphatase 1 0.0037 0.0341 0.0334
Trypanosoma brucei DNA polymerase IV, putative 0.002 0.01 0.0738
Plasmodium vivax hypothetical protein, conserved 0.003 0.0241 0.2152
Loa Loa (eye worm) hypothetical protein 0.0076 0.0877 0.4589
Brugia malayi Intermediate filament tail domain containing protein 0.0027 0.0202 0.1044
Loa Loa (eye worm) beta-lactamase 0.0076 0.0877 0.4589
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.05 0.0493
Entamoeba histolytica hypothetical protein 0.0036 0.032 0.2049
Mycobacterium tuberculosis Probable reductase 0.0114 0.1415 0.2081
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0017 0.0067 0.0336
Echinococcus multilocularis peregrin 0.003 0.0241 0.0234
Brugia malayi beta-lactamase 0.0076 0.0877 0.4581
Plasmodium vivax kinesin-5 0.0032 0.0272 0.2537
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0027 0.0202 0.1056
Echinococcus multilocularis PHD finger protein rhinoceros 0.003 0.0241 0.0234
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0098 0.1188 0.1181
Loa Loa (eye worm) hypothetical protein 0.0022 0.0136 0.0713
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0076 0.0877 0.1251
Leishmania major DNA polymerase kappa, putative 0.002 0.01 0.0305
Schistosoma mansoni lamin 0.0027 0.0202 0.0142
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.05 0.0493
Trypanosoma brucei DNA polymerase eta, putative 0.002 0.01 0.0738
Echinococcus granulosus geminin 0.0503 0.6819 0.6816
Echinococcus multilocularis lamin dm0 0.0027 0.0202 0.0195
Echinococcus multilocularis beta LACTamase domain containing family member 0.0076 0.0877 0.0871
Onchocerca volvulus 0.0076 0.0877 0.7147
Echinococcus multilocularis matrix metallopeptidase 7 (M10 family) 0.0081 0.0956 0.095
Leishmania major trypanothione reductase 0.005 0.0522 0.4118
Brugia malayi jmjC domain containing protein 0.0038 0.0351 0.1828
Echinococcus granulosus muscleblind protein 0.015 0.1912 0.1906
Giardia lamblia PHD finger protein 15 0.003 0.0241 0.1576
Echinococcus granulosus inositol monophosphatase 1 0.0037 0.0341 0.0334
Entamoeba histolytica serine/threonine protein kinase, putative 0.0097 0.1173 1
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.002 0.01 0.004
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0076 0.0877 0.0821
Mycobacterium leprae Probable lipase LipE 0.0076 0.0877 0.4847
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.01 0.0738
Trichomonas vaginalis CAMK family protein kinase 0.0097 0.1173 1
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0127 0.1593 0.2355
Brugia malayi PHD-finger family protein 0.003 0.0241 0.1249
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.05 0.0493
Trypanosoma cruzi polo-like protein kinase, putative 0.0097 0.1173 1
Echinococcus granulosus matrix metallopeptidase 7 M10 family 0.0081 0.0956 0.095
Trypanosoma cruzi DNA polymerase kappa, putative 0.002 0.01 0.0305
Brugia malayi Matrixin family protein 0.0022 0.0136 0.07
Loa Loa (eye worm) hypothetical protein 0.0076 0.0877 0.4589
Mycobacterium ulcerans beta-lactamase 0.0076 0.0877 1
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0037 0.0341 0.248
Loa Loa (eye worm) hypothetical protein 0.0027 0.0204 0.1067
Brugia malayi Inositol-1 0.0037 0.0341 0.1773
Brugia malayi cytoplasmic intermediate filament protein 0.0015 0.0027 0.0127
Loa Loa (eye worm) hypothetical protein 0.0022 0.0136 0.0713
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0114 0.1415 0.2081
Echinococcus granulosus lamin dm0 0.0027 0.0202 0.0195
Echinococcus multilocularis musashi 0.0027 0.0202 0.0195
Loa Loa (eye worm) hypothetical protein 0.0022 0.0136 0.0713
Plasmodium falciparum kinesin-5 0.0032 0.0272 0.4513
Schistosoma mansoni hypothetical protein 0.0031 0.0257 0.0197
Trypanosoma cruzi trypanothione reductase, putative 0.005 0.0522 0.4118
Brugia malayi hypothetical protein 0.0036 0.032 0.1664
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.005 0.0522 0.0703
Echinococcus multilocularis cpg binding protein 0.003 0.0249 0.0242
Trypanosoma brucei DNA polymerase IV, putative 0.002 0.01 0.0738
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0017 0.0067 0.006
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.01 0.0738
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.01 0.0738
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.01 0.0738
Mycobacterium ulcerans DNA polymerase IV 0.002 0.01 0.0417
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0031 0.0257 0.025
Echinococcus granulosus dna polymerase kappa 0.002 0.01 0.0094
Echinococcus multilocularis microtubule associated protein 2 0.0731 1 1
Echinococcus multilocularis dnaJ subfamily B 0.0411 0.5539 0.5536
Brugia malayi intermediate filament protein 0.0027 0.0202 0.1044
Schistosoma mansoni DNA polymerase eta 0.002 0.01 0.004
Schistosoma mansoni hypothetical protein 0.0503 0.6819 0.6799
Mycobacterium leprae conserved hypothetical protein 0.0076 0.0877 0.4847
Loa Loa (eye worm) hypothetical protein 0.015 0.1912 1
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0037 0.0341 0.2243
Toxoplasma gondii thioredoxin reductase 0.005 0.0522 0.5621
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.01 0.0738
Echinococcus multilocularis dna polymerase eta 0.002 0.01 0.0094
Mycobacterium tuberculosis Conserved protein 0.0076 0.0877 0.1251
Echinococcus granulosus dnaJ subfamily B 0.0411 0.5539 0.5536
Loa Loa (eye worm) hypothetical protein 0.0027 0.0195 0.102
Echinococcus granulosus lamin 0.0027 0.0202 0.0195
Loa Loa (eye worm) CXXC zinc finger family protein 0.0029 0.0226 0.1184
Schistosoma mansoni hypothetical protein 0.0503 0.6819 0.6799
Giardia lamblia Kinase, PLK 0.0097 0.1173 1
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0098 0.1188 0.1181
Mycobacterium ulcerans esterase/lipase LipP 0.0076 0.0877 1
Brugia malayi jmjC domain containing protein 0.0098 0.1188 0.6207
Mycobacterium tuberculosis Probable dehydrogenase 0.0114 0.1415 0.2081
Echinococcus multilocularis geminin 0.0503 0.6819 0.6816
Trichomonas vaginalis CAMK family protein kinase 0.0097 0.1173 1
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0037 0.0341 1
Loa Loa (eye worm) hypothetical protein 0.0098 0.1189 0.622
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). 0.0033 0.0287 0.0597
Mycobacterium ulcerans hydrolase 0.0027 0.0204 0.1695
Brugia malayi Matrixin family protein 0.0022 0.0136 0.07
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.0017 0.0067 0.0446
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0048 0.05 0.2613
Echinococcus granulosus GPCR family 2 0.0031 0.0257 0.025
Echinococcus granulosus jumonji domain containing protein 0.0042 0.0404 0.0397
Trypanosoma brucei unspecified product 0.002 0.01 0.0738
Brugia malayi beta-lactamase family protein 0.0076 0.0877 0.4581
Echinococcus multilocularis thioredoxin glutathione reductase 0.005 0.0522 0.0516
Toxoplasma gondii PHD-finger domain-containing protein 0.003 0.0241 0.2152
Trichomonas vaginalis D-aminoacylase, putative 0.0076 0.0877 0.7327
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.0017 0.0067 0.0446
Trichomonas vaginalis esterase, putative 0.0076 0.0877 0.7327
Schistosoma mansoni intermediate filament proteins 0.0027 0.0202 0.0142
Mycobacterium ulcerans lipase LipD 0.0076 0.0877 1
Loa Loa (eye worm) hypothetical protein 0.0076 0.0877 0.4589
Mycobacterium tuberculosis Probable lipase LipE 0.0076 0.0877 0.1251
Onchocerca volvulus 0.0027 0.0202 0.0632
Trypanosoma cruzi hypothetical protein, conserved 0.0076 0.0877 0.7327
Echinococcus multilocularis dna polymerase kappa 0.002 0.01 0.0094
Plasmodium falciparum glutathione reductase 0.005 0.0522 1
Brugia malayi Latrophilin receptor protein 2 0.0031 0.0257 0.1331
Loa Loa (eye worm) hypothetical protein 0.0076 0.0877 0.4589
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0097 0.1173 1
Schistosoma mansoni hypothetical protein 0.003 0.0241 0.0181
Loa Loa (eye worm) hypothetical protein 0.0076 0.0877 0.4589
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0114 0.1415 0.8722
Loa Loa (eye worm) jmjC domain-containing protein 0.0038 0.0351 0.1839
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.05 0.0493
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.002 0.01 0.0526
Giardia lamblia DINP protein human, muc B family 0.002 0.01 0.0305
Trichomonas vaginalis CAMK family protein kinase 0.0097 0.1173 1
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0076 0.0877 0.1251
Brugia malayi F/Y-rich N-terminus family protein 0.0019 0.0084 0.0424
Trichomonas vaginalis D-aminoacylase, putative 0.0076 0.0877 0.7327
Schistosoma mansoni jumonji/arid domain-containing protein 0.0038 0.0351 0.0293
Mycobacterium ulcerans hypothetical protein 0.0076 0.0877 1
Echinococcus granulosus peregrin 0.003 0.0241 0.0234
Echinococcus granulosus cpg binding protein 0.003 0.0249 0.0242
Schistosoma mansoni hypothetical protein 0.0036 0.032 0.0261
Trypanosoma cruzi polo-like protein kinase, putative 0.0097 0.1173 1
Echinococcus multilocularis GPCR, family 2 0.0031 0.0257 0.025
Echinococcus multilocularis muscleblind protein 1 0.015 0.1912 0.1906
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0483 0.6547 1
Schistosoma mansoni cpg binding protein 0.003 0.0249 0.019
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0097 0.1173 0.6136
Mycobacterium tuberculosis Conserved protein 0.0076 0.0877 0.1251
Mycobacterium tuberculosis Probable peptidoglycan hydrolase 0.0027 0.0204 0.0212
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0017 0.0067 0.006
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0098 0.1189 0.622
Schistosoma mansoni lamin 0.0027 0.0202 0.0142
Leishmania major hypothetical protein, conserved 0.0076 0.0877 0.7327
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.05 0.0442
Trypanosoma cruzi DNA polymerase kappa, putative 0.002 0.01 0.0305
Trichomonas vaginalis CAMK family protein kinase 0.0048 0.0492 0.3847
Brugia malayi Hemopexin family protein 0.0032 0.0266 0.1381
Trichomonas vaginalis DNA polymerase eta, putative 0.002 0.01 0.0305
Schistosoma mansoni kinase 0.0049 0.051 0.0452
Loa Loa (eye worm) hypothetical protein 0.015 0.1912 1
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0098 0.1189 0.6215
Trichomonas vaginalis penicillin-binding protein, putative 0.0076 0.0877 0.7327
Brugia malayi Matrixin family protein 0.0022 0.0136 0.07
Loa Loa (eye worm) kinesin-like protein KLP2 0.0032 0.0272 0.1424
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.05 0.0442
Toxoplasma gondii ABC1 family protein 0.0076 0.0877 1
Plasmodium vivax glutathione reductase, putative 0.005 0.0522 0.5621

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 0.02 uM Inhibition of human ATPase activity KSP expressed in Escherichia coli after 30 mins by spectrophotometric analysis ChEMBL. 21856161
IC50 (functional) > 10 uM Cytotoxicity against human A549 cells after 48 hrs by SRB assay ChEMBL. 21856161
IC50 (functional) > 10 uM Cytotoxicity against human AGS cells after 48 hrs by SRB assay ChEMBL. 21856161

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens ChEMBL23 21856161

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
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External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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