Detailed information for compound 1183541

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 444.522 | Formula: C27H28N2O4
  • H donors: 1 H acceptors: 3 LogP: 3.32 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: COC(=O)C1=C(C[C@H]2N([C@@H]1CC2)C(=O)NC1Cc2c(C1)cccc2)c1ccc(cc1)C(=O)C
  • InChi: 1S/C27H28N2O4/c1-16(30)17-7-9-18(10-8-17)23-15-22-11-12-24(25(23)26(31)33-2)29(22)27(32)28-21-13-19-5-3-4-6-20(19)14-21/h3-10,21-22,24H,11-15H2,1-2H3,(H,28,32)/t22-,24+/m0/s1
  • InChiKey: LWLOVGHXJOCFLI-LADGPHEKSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

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
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0201 0.2685 0.2685
Onchocerca volvulus 0.0056 0.0531 0.1977
Mycobacterium tuberculosis Probable lipase LipE 0.0079 0.0871 0.0918
Trichomonas vaginalis CMGC family protein kinase 0.0052 0.046 0.0452
Echinococcus granulosus survival motor neuron protein 1 0.0245 0.3346 0.3346
Schistosoma mansoni inositol monophosphatase 0.004 0.029 0.029
Echinococcus multilocularis thioredoxin glutathione reductase 0.0052 0.0458 0.0458
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.005 0.0435 0.1162
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0032 0.0168 0.0168
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0108 0.1298 0.1298
Brugia malayi MH2 domain containing protein 0.0116 0.142 0.3795
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0078 0.0857 0.5
Echinococcus multilocularis importin subunit beta 1 0.0061 0.0601 0.0601
Loa Loa (eye worm) inositol-1 0.004 0.029 0.0307
Mycobacterium ulcerans esterase/lipase LipP 0.0079 0.0871 0.4598
Loa Loa (eye worm) hypothetical protein 0.0028 0.0099 0.0105
Schistosoma mansoni ran 0.0045 0.036 0.036
Echinococcus granulosus mitogen activated protein kinase 3 0.0052 0.046 0.046
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0293 0.4056 1
Trypanosoma brucei trypanothione reductase 0.0052 0.0458 0.1511
Trichomonas vaginalis CAMK family protein kinase 0.0201 0.2685 0.6361
Loa Loa (eye worm) hypothetical protein 0.0078 0.0857 0.0909
Mycobacterium tuberculosis Conserved protein 0.0079 0.0871 0.0918
Brugia malayi beta-lactamase 0.0079 0.0871 0.2328
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0045 0.036 0.0382
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0293 0.4056 1
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0045 0.036 0.036
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0052 0.046 0.1518
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0079 0.0871 0.0918
Echinococcus multilocularis snurportin 1 0.0653 0.9431 0.9431
Echinococcus granulosus inositol monophosphatase 1 0.004 0.029 0.029
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.004 0.029 0.0869
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0078 0.0857 0.1932
Loa Loa (eye worm) cytochrome P450 family protein 0.0025 0.0062 0.0065
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0078 0.0857 0.9823
Mycobacterium ulcerans lipase LipD 0.0079 0.0871 0.4598
Echinococcus multilocularis mitogen activated protein kinase 0.0052 0.046 0.046
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.0143 0.1822 1
Trypanosoma cruzi trypanothione reductase, putative 0.0052 0.0458 0.1511
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0108 0.1298 0.1298
Trypanosoma cruzi importin beta-1 subunit, putative 0.005 0.0429 0.1399
Echinococcus multilocularis tumor protein p63 0.0386 0.5442 0.5442
Schistosoma mansoni peptidase Clp (S14 family) 0.0078 0.0857 0.0857
Trypanosoma brucei mitogen activated protein kinase 4, putative 0.0052 0.046 0.1518
Plasmodium vivax thioredoxin reductase, putative 0.0052 0.0458 0.4703
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0293 0.4056 1
Brugia malayi hypothetical protein 0.0245 0.3346 0.8942
Schistosoma mansoni hypothetical protein 0.0342 0.4787 0.4787
Brugia malayi RNA binding protein 0.0066 0.0669 0.1786
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0108 0.1298 0.1298
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0052 0.0458 0.033
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0293 0.4056 1
Loa Loa (eye worm) RNA binding protein 0.0066 0.0669 0.0709
Entamoeba histolytica hypothetical protein 0.005 0.0429 0.0369
Schistosoma mansoni hypothetical protein 0.007 0.0725 0.0725
Echinococcus granulosus tar DNA binding protein 0.0066 0.0669 0.0669
Echinococcus granulosus GPCR family 2 0.0032 0.0168 0.0168
Leishmania major hypothetical protein, conserved 0.0028 0.0099 0.0142
Loa Loa (eye worm) hypothetical protein 0.0079 0.0871 0.0924
Echinococcus multilocularis beta LACTamase domain containing family member 0.0079 0.0871 0.0871
Trichomonas vaginalis D-aminoacylase, putative 0.0079 0.0871 0.1544
Mycobacterium leprae conserved hypothetical protein 0.0079 0.0871 0.4505
Mycobacterium tuberculosis Conserved protein 0.0079 0.0871 0.0918
Loa Loa (eye worm) hypothetical protein 0.0245 0.3346 0.3548
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0118 0.1444 0.1735
Trichomonas vaginalis CAMK family protein kinase 0.01 0.1176 0.2352
Schistosoma mansoni hypothetical protein 0.0032 0.0168 0.0168
Trichomonas vaginalis CAMK family protein kinase 0.01 0.1176 0.2352
Plasmodium falciparum ataxin-2 like protein, putative 0.0028 0.0099 0.0098
Mycobacterium leprae Probable lipase LipE 0.0079 0.0871 0.4505
Plasmodium falciparum ataxin-2 like protein, putative 0.0028 0.0099 0.0098
Loa Loa (eye worm) hypothetical protein 0.0102 0.1205 0.1277
Brugia malayi beta-lactamase family protein 0.0079 0.0871 0.2328
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.0051 0.0455 0.0325
Echinococcus granulosus GTP binding nuclear protein Ran 0.0045 0.036 0.036
Entamoeba histolytica serine/threonine protein kinase, putative 0.0201 0.2685 0.6361
Trypanosoma cruzi polo-like protein kinase, putative 0.0201 0.2685 1
Brugia malayi beta-lactamase family protein 0.0079 0.0871 0.2328
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0079 0.0871 0.2328
Trypanosoma brucei importin beta-1 subunit, putative 0.0061 0.0601 0.2057
Schistosoma mansoni hypothetical protein 0.0653 0.9431 0.9431
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0108 0.1298 0.1298
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0055 0.0514 0.0514
Schistosoma mansoni importin beta-1 0.0061 0.0601 0.0601
Trichomonas vaginalis penicillin-binding protein, putative 0.0079 0.0871 0.1544
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0055 0.0514 0.0514
Schistosoma mansoni lipoxygenase 0.0055 0.0514 0.0514
Brugia malayi Cytochrome P450 family protein 0.0025 0.0062 0.0165
Trypanosoma brucei importin beta-1 subunit, putative 0.0061 0.0601 0.2057
Plasmodium vivax glutathione reductase, putative 0.0052 0.0458 0.4703
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0045 0.036 0.3513
Trichomonas vaginalis D-aminoacylase, putative 0.0079 0.0871 0.1544
Echinococcus granulosus thioredoxin glutathione reductase 0.0052 0.0458 0.0458
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0653 0.9431 1
Trichomonas vaginalis CAMK family protein kinase 0.0201 0.2685 0.6361
Loa Loa (eye worm) transcription factor SMAD2 0.0116 0.142 0.1506
Loa Loa (eye worm) hypothetical protein 0.0079 0.0871 0.0924
Loa Loa (eye worm) latrophilin receptor protein 2 0.0032 0.0168 0.0179
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). 0.0036 0.0227 0.0782
Trichomonas vaginalis D-aminoacylase, putative 0.0079 0.0871 0.1544
Loa Loa (eye worm) cytochrome P450 family protein 0.0036 0.023 0.0243
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.0143 0.1822 0.2274
Trypanosoma cruzi PAB1-binding protein , putative 0.0028 0.0099 0.0142
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0079 0.0871 0.0924
Onchocerca volvulus Serine\/threonine kinase homolog 0.0201 0.2685 1
Brugia malayi Importin beta-1 subunit 0.0061 0.0601 0.1607
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0118 0.1444 0.1735
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.004 0.029 0.2544
Plasmodium vivax importin-beta 2, putative 0.0061 0.0601 0.6541
Toxoplasma gondii LsmAD domain-containing protein 0.0028 0.0099 0.0096
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0102 0.1205 0.1277
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0078 0.0857 0.9823
Schistosoma mansoni cellular tumor antigen P53 0.0056 0.0531 0.0531
Brugia malayi MAP kinase sur-1 0.0052 0.046 0.1229
Brugia malayi Inositol-1 0.004 0.029 0.0774
Trypanosoma cruzi hypothetical protein, conserved 0.0079 0.0871 0.3085
Loa Loa (eye worm) hypothetical protein 0.0079 0.0871 0.0924
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0066 0.0669 0.0709
Brugia malayi serine/threonine-protein kinase plk-2 0.0201 0.2685 0.7175
Trichomonas vaginalis Importin beta-1 subunit, putative 0.005 0.0429 0.0369
Loa Loa (eye worm) hypothetical protein 0.0079 0.0871 0.0924
Trichomonas vaginalis CAMK family protein kinase 0.0201 0.2685 0.6361
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0078 0.0857 0.5
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.004 0.029 0.0869
Schistosoma mansoni tar DNA-binding protein 0.0066 0.0669 0.0669
Brugia malayi Cytochrome P450 family protein 0.0025 0.0062 0.0165
Brugia malayi RNA, U transporter 1 0.0174 0.2284 0.6103
Loa Loa (eye worm) hypothetical protein 0.007 0.0725 0.0769
Trichomonas vaginalis CMGC family protein kinase 0.0052 0.046 0.0452
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0293 0.4056 1
Echinococcus granulosus tumor protein p63 0.0386 0.5442 0.5442
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0131 0.1639 0.2014
Schistosoma mansoni hypothetical protein 0.0032 0.0168 0.0168
Trichomonas vaginalis esterase, putative 0.0079 0.0871 0.1544
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0032 0.0168 0.045
Giardia lamblia Kinase, CMGC MAPK 0.0052 0.046 0.0269
Plasmodium falciparum importin beta, putative 0.0061 0.0601 0.6659
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0078 0.0857 1
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0293 0.4056 1
Loa Loa (eye worm) glutathione reductase 0.0052 0.0458 0.0486
Onchocerca volvulus 0.0079 0.0871 0.3244
Trichomonas vaginalis ran, putative 0.0045 0.036 0.0188
Brugia malayi Probable ClpP-like protease 0.0078 0.0857 0.2291
Plasmodium falciparum thioredoxin reductase 0.0052 0.0458 0.4788
Brugia malayi Cytochrome P450 family protein 0.0036 0.023 0.0613
Mycobacterium tuberculosis Probable esterase LipL 0.0079 0.0871 0.0918
Trichomonas vaginalis CAMK family protein kinase 0.0201 0.2685 0.6361
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.0051 0.0455 0.0325
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.0143 0.1822 1
Echinococcus multilocularis survival motor neuron protein 1 0.0245 0.3346 0.3346
Echinococcus multilocularis GPCR, family 2 0.0032 0.0168 0.0168
Loa Loa (eye worm) hypothetical protein 0.0061 0.0601 0.0638
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0108 0.1298 0.1298
Echinococcus multilocularis geminin 0.0342 0.4787 0.4787
Echinococcus multilocularis mitogen activated protein kinase 3 0.0052 0.046 0.046
Trichomonas vaginalis CMGC family protein kinase 0.0052 0.046 0.0452
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0118 0.1444 0.7813
Schistosoma mansoni tar DNA-binding protein 0.0066 0.0669 0.0669
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.004 0.029 0.0869
Plasmodium vivax hypothetical protein, conserved 0.0079 0.0871 1
Loa Loa (eye worm) cytochrome P450 family protein 0.0025 0.0062 0.0065
Onchocerca volvulus 0.0079 0.0871 0.3244
Entamoeba histolytica Ran family GTPase 0.0045 0.036 0.0188
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0108 0.1298 0.3468
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0079 0.0871 0.0871
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0118 0.1444 0.1735
Trichomonas vaginalis CMGC family protein kinase 0.0052 0.046 0.0452
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0078 0.0857 0.0857
Leishmania major GTP-binding protein, putative 0.0045 0.036 0.1139
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0078 0.0857 0.4519
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0079 0.0871 0.0918
Brugia malayi latrophilin 2 splice variant baaae 0.007 0.0725 0.1937
Toxoplasma gondii CMGC kinase, MAPK family (ERK) MAPK-1 0.0052 0.046 0.4726
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0045 0.036 0.0963
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0032 0.0168 0.0168
Loa Loa (eye worm) TAR-binding protein 0.0066 0.0669 0.0709
Schistosoma mansoni serine/threonine protein kinase 0.0201 0.2685 0.2685
Loa Loa (eye worm) thioredoxin reductase 0.0052 0.0458 0.0486
Leishmania major importin beta-1 subunit, putative 0.005 0.0429 0.1399
Trichomonas vaginalis CAMK family protein kinase 0.0201 0.2685 0.6361
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0045 0.036 0.1139
Mycobacterium tuberculosis Probable lipase LipD 0.0079 0.0871 0.0918
Leishmania major hypothetical protein, conserved 0.0079 0.0871 0.3085
Mycobacterium tuberculosis Conserved protein 0.0079 0.0871 0.0918
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0201 0.2685 1
Onchocerca volvulus 0.005 0.0435 0.1619
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.0051 0.0455 0.2099
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0131 0.1639 0.2014
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0079 0.0871 0.0871
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.004 0.029 0.0869
Brugia malayi RNA recognition motif domain containing protein 0.0066 0.0669 0.1786
Schistosoma mansoni ran 0.0045 0.036 0.036
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0079 0.0871 0.4598
Toxoplasma gondii thioredoxin reductase 0.0052 0.0458 0.4703
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0272 0.3742 0.3968
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0201 0.2685 0.2685
Leishmania major trypanothione reductase 0.0052 0.0458 0.1511
Trypanosoma brucei protein kinase, putative 0.0052 0.046 0.1518
Schistosoma mansoni hypothetical protein 0.0032 0.0168 0.0168
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0032 0.0168 0.0168
Echinococcus granulosus importin subunit beta 1 0.0061 0.0601 0.0601
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.004 0.029 0.1295
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0078 0.0857 0.9823
Echinococcus granulosus beta LACTamase domain containing family member 0.0079 0.0871 0.0871
Schistosoma mansoni hypothetical protein 0.0032 0.0168 0.0168
Mycobacterium tuberculosis Probable reductase 0.0118 0.1444 0.1735
Echinococcus multilocularis peptidase Clp (S14 family) 0.0051 0.0455 0.0455
Leishmania major mitogen activated protein kinase, putative,map kinase, putative 0.0052 0.046 0.1518
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0507 0.7242 1
Giardia lamblia Fructose-bisphosphate aldolase 0.0293 0.4056 1
Trypanosoma cruzi mitogen activated protein kinase 4, putative 0.0052 0.046 0.1518
Schistosoma mansoni tar DNA-binding protein 0.0066 0.0669 0.0669
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0293 0.4056 1
Trypanosoma brucei polo-like protein kinase 0.0201 0.2685 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0108 0.1298 0.1298
Schistosoma mansoni tar DNA-binding protein 0.0066 0.0669 0.0669
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 0.0045 0.036 0.3451
Mycobacterium ulcerans beta-lactamase 0.0079 0.0871 0.4598
Mycobacterium tuberculosis Probable oxidoreductase 0.0131 0.1639 0.2014
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0293 0.4056 1
Trypanosoma brucei PAB1-binding protein , putative 0.0028 0.0099 0.0142
Toxoplasma gondii HEAT repeat-containing protein 0.0061 0.0601 0.6541
Brugia malayi hypothetical protein 0.0028 0.0099 0.0264
Trypanosoma cruzi polo-like protein kinase, putative 0.0201 0.2685 1
Schistosoma mansoni hypothetical protein 0.0342 0.4787 0.4787
Giardia lamblia Kinase, PLK 0.0201 0.2685 0.6291
Loa Loa (eye worm) hypothetical protein 0.0032 0.0168 0.0179
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0032 0.0168 0.0168
Schistosoma mansoni survival motor neuron protein 0.005 0.0435 0.0435
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0045 0.036 0.3451
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0108 0.1298 0.1298
Trichomonas vaginalis CAMK family protein kinase 0.0201 0.2685 0.6361
Trichomonas vaginalis Importin beta-1 subunit, putative 0.005 0.0429 0.0369
Toxoplasma gondii ABC1 family protein 0.0079 0.0871 1
Schistosoma mansoni kinase 0.0102 0.1215 0.1215
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0078 0.0857 0.4519
Trypanosoma cruzi PAB1-binding protein , putative 0.0028 0.0099 0.0142
Schistosoma mansoni serine/threonine protein kinase 0.0052 0.046 0.046
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.0052 0.046 0.0488
Brugia malayi Thioredoxin reductase 0.0052 0.0458 0.1224
Echinococcus multilocularis tar DNA binding protein 0.0066 0.0669 0.0669
Brugia malayi TAR-binding protein 0.0066 0.0669 0.1786
Loa Loa (eye worm) beta-lactamase 0.0079 0.0871 0.0924
Echinococcus granulosus geminin 0.0342 0.4787 0.4787
Trichomonas vaginalis penicillin-binding protein, putative 0.0079 0.0871 0.1544
Plasmodium vivax ataxin-2 like protein, putative 0.0028 0.0099 0.0096
Echinococcus multilocularis inositol monophosphatase 1 0.004 0.029 0.029
Onchocerca volvulus 0.0079 0.0871 0.3244
Trypanosoma cruzi hypothetical protein, conserved 0.0079 0.0871 0.3085
Echinococcus granulosus peptidase Clp S14 family 0.0051 0.0455 0.0455
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0078 0.0857 0.4425
Brugia malayi glutathione reductase 0.0052 0.0458 0.1224
Mycobacterium ulcerans hypothetical protein 0.0079 0.0871 0.4598
Mycobacterium tuberculosis Probable hydrolase 0.0079 0.0871 0.0918
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0118 0.1444 0.1735
Loa Loa (eye worm) hypothetical protein 0.0056 0.0531 0.0563
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0131 0.1639 0.8945
Loa Loa (eye worm) CYP4Cod1 0.0025 0.0062 0.0065
Brugia malayi Calcitonin receptor-like protein seb-1 0.0102 0.1205 0.3219
Loa Loa (eye worm) hypothetical protein 0.0079 0.0871 0.0924
Echinococcus granulosus mitogen activated protein kinase 0.0052 0.046 0.046
Loa Loa (eye worm) hypothetical protein 0.0079 0.0871 0.0924
Echinococcus granulosus snurportin 1 0.0653 0.9431 0.9431
Trichomonas vaginalis importin beta-1, putative 0.005 0.0429 0.0369
Mycobacterium tuberculosis Probable dehydrogenase 0.0118 0.1444 0.1735
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0102 0.1205 0.3219
Treponema pallidum fructose-bisphosphate aldolase 0.0293 0.4056 1
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative 0.0045 0.036 0.1139
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0052 0.046 0.1518
Leishmania major mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440 0.0052 0.046 0.1518
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0078 0.0857 1
Trichomonas vaginalis CAMK family protein kinase 0.0201 0.2685 0.6361
Loa Loa (eye worm) MH2 domain-containing protein 0.0116 0.142 0.1506
Plasmodium falciparum glutathione reductase 0.0052 0.0458 0.4788
Brugia malayi Latrophilin receptor protein 2 0.0032 0.0168 0.045
Schistosoma mansoni inositol monophosphatase 0.004 0.029 0.029
Schistosoma mansoni tar DNA-binding protein 0.0066 0.0669 0.0669
Schistosoma mansoni hypothetical protein 0.005 0.0435 0.0435
Brugia malayi follicle stimulating hormone receptor 0.0272 0.3742 1
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0045 0.036 0.1139
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0108 0.1298 0.1376
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0201 0.2685 0.2847
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0293 0.4056 1
Trypanosoma cruzi mitogen activated protein kinase 2, putative 0.0052 0.046 0.1518
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0078 0.0857 0.0857
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0079 0.0871 0.0918
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0293 0.4056 1
Trypanosoma brucei hypothetical protein, conserved 0.0079 0.0871 0.3085

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 10.4179 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 25.1189 uM PUBCHEM_BIOASSAY: Inhibitors of TCP-1 ring complex (TRiC) of Methanococcus maripaludis (MmCpn): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488991] ChEMBL. No reference
Potency (functional) 39.8107 uM PubChem BioAssay. qHTS of Trypanosoma Brucei Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] ChEMBL. No reference
Potency (functional) 100 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] 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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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