Detailed information for compound 915282

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 1154.32 | Formula: C60H75N13O11
  • H donors: 12 H acceptors: 12 LogP: 1.66 Rotable bonds: 39
    Rule of 5 violations (Lipinski): 4
  • SMILES: CNCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)Cc1ccccc1)Cc1[nH]cnc1)[C@H](CC)C)Cc1ccc(cc1)O)Cc1ccc(cc1)C(=O)c1ccccc1)CCCNC(=N)N
  • InChi: 1S/C60H75N13O11/c1-4-36(2)51(57(81)70-47(32-42-33-64-35-66-42)58(82)73-28-12-18-49(73)56(80)71-48(59(83)84)31-37-13-7-5-8-14-37)72-55(79)46(30-39-21-25-43(74)26-22-39)69-54(78)45(29-38-19-23-41(24-20-38)52(76)40-15-9-6-10-16-40)68-53(77)44(67-50(75)34-63-3)17-11-27-65-60(61)62/h5-10,13-16,19-26,33,35-36,44-49,51,63,74H,4,11-12,17-18,27-32,34H2,1-3H3,(H,64,66)(H,67,75)(H,68,77)(H,69,78)(H,70,81)(H,71,80)(H,72,79)(H,83,84)(H4,61,62,65)/t36-,44-,45-,46-,47-,48-,49-,51-/m0/s1
  • InChiKey: PXNIGPMZOUUXMA-FSKISDTGSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens angiotensin II receptor, type 1 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Echinococcus granulosus pyroglutamylated rfamide peptide receptor angiotensin II receptor, type 1 359 aa 403 aa 19.1 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Schistosoma mansoni hypothetical protein 0.0018 0.0015 0.0018
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0112 0.1111 0.1335
Trichomonas vaginalis glucosylceramidase, putative 0.0174 0.1846 0.2838
Plasmodium falciparum FAD-linked sulfhydryl oxidase ERV1, putative 0.004 0.0266 0.7091
Mycobacterium ulcerans aldehyde dehydrogenase 0.0065 0.0565 0.0868
Brugia malayi glutaminase DH11.1 0.0571 0.6503 0.8709
Echinococcus multilocularis GPCR, family 2 0.0033 0.0184 0.0184
Echinococcus multilocularis lamin 0.003 0.0148 0.0148
Loa Loa (eye worm) bromodomain containing protein 0.0021 0.0049 0.0045
Brugia malayi glutathione reductase 0.0049 0.0375 0.0503
Schistosoma mansoni aldehyde dehydrogenase 0.0065 0.0565 0.0649
Mycobacterium ulcerans glutaminase 0.0571 0.6503 1
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.002 0.0034 0.0025
Onchocerca volvulus 0.003 0.0148 0.0349
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0103 0.1012 0.1339
Trypanosoma cruzi Present in the outer mitochondrial membrane proteome 4 0.004 0.0266 0.2345
Trypanosoma brucei trypanothione reductase 0.0049 0.0375 0.3308
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0065 0.0565 0.0565
Mycobacterium tuberculosis Probable reductase 0.0112 0.1111 0.1335
Trichomonas vaginalis glucosylceramidase, putative 0.0174 0.1846 0.2838
Brugia malayi PHD-finger family protein 0.003 0.015 0.0201
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0112 0.1111 0.8751
Mycobacterium tuberculosis Probable oxidoreductase 0.0124 0.1258 0.1511
Loa Loa (eye worm) hypothetical protein 0.0033 0.0184 0.0227
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0027 0.0117 0.0117
Schistosoma mansoni hypothetical protein 0.0033 0.0184 0.0212
Schistosoma mansoni ap endonuclease 0.002 0.0034 0.0039
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0114 0.1135 0.1306
Trichomonas vaginalis penicillin-binding protein, putative 0.0114 0.1135 0.1745
Loa Loa (eye worm) glutaminase 0.0571 0.6503 0.8706
Trichomonas vaginalis glucosylceramidase, putative 0.0266 0.2917 0.4486
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0112 0.1111 0.1335
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0262 0.2875 0.3851
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.002 0.0034 0.0039
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0114 0.1135 0.1306
Loa Loa (eye worm) glutaminase 2 0.0571 0.6503 0.8706
Loa Loa (eye worm) latrophilin receptor protein 2 0.0033 0.0184 0.0227
Echinococcus granulosus intermediate filament protein 0.003 0.0148 0.0171
Plasmodium vivax hypothetical protein, conserved 0.0114 0.1135 1
Echinococcus granulosus histone lysine methyltransferase setb 0.002 0.004 0.0046
Schistosoma mansoni hypothetical protein 0.0033 0.0184 0.0212
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0124 0.1258 1
Echinococcus granulosus fetal alzheimer antigen falz 0.0027 0.0117 0.0135
Toxoplasma gondii Erv1 / Alr family protein 0.004 0.0266 0.2345
Trichomonas vaginalis glucosylceramidase, putative 0.0266 0.2917 0.4486
Mycobacterium tuberculosis Probable dehydrogenase 0.0112 0.1111 0.1335
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0112 0.1111 0.1335
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0146 0.1513 0.1741
Trypanosoma cruzi Present in the outer mitochondrial membrane proteome 4 0.004 0.0266 0.2345
Echinococcus granulosus GPCR family 2 0.0033 0.0184 0.0212
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.002 0.0034 0.0295
Treponema pallidum exodeoxyribonuclease (exoA) 0.002 0.0034 1
Loa Loa (eye worm) beta-lactamase 0.0114 0.1135 0.1503
Trypanosoma cruzi hypothetical protein, conserved 0.0114 0.1135 1
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0024 0.0087 0.0105
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0056 0.0455 0.0609
Loa Loa (eye worm) glutathione reductase 0.0049 0.0375 0.0484
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0114 0.1135 0.1363
Loa Loa (eye worm) intermediate filament protein 0.003 0.0148 0.0179
Trypanosoma cruzi ERV/ALR sulfhydryl oxidase domain-containing protein 0.004 0.0266 0.2345
Plasmodium vivax thioredoxin reductase, putative 0.0049 0.0375 0.3308
Loa Loa (eye worm) hypothetical protein 0.0114 0.1135 0.1503
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.002 0.004 0.0046
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0024 0.0087 0.0134
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0114 0.1135 0.1363
Trypanosoma brucei PAB1-binding protein , putative 0.0026 0.0107 0.0944
Echinococcus granulosus lamin dm0 0.003 0.0148 0.0171
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0146 0.1513 0.1741
Trypanosoma cruzi trypanothione reductase, putative 0.0049 0.0375 0.3308
Echinococcus granulosus beta LACTamase domain containing family member 0.0114 0.1135 0.1306
Entamoeba histolytica acyl-coA synthetase, putative 0.0024 0.0087 1
Loa Loa (eye worm) PHD-finger family protein 0.0025 0.009 0.0101
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0017 0.0003 0.0004
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0033 0.0184 0.0247
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0017 0.0003 0.0004
Brugia malayi Bromodomain containing protein 0.0046 0.0338 0.0452
Schistosoma mansoni survival motor neuron protein 0.0056 0.0455 0.0524
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0065 0.0565 0.4975
Loa Loa (eye worm) hypothetical protein 0.0026 0.0107 0.0124
Trichomonas vaginalis D-aminoacylase, putative 0.0114 0.1135 0.1745
Echinococcus granulosus survival motor neuron protein 1 0.0273 0.3008 0.346
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0146 0.1513 0.2027
Onchocerca volvulus 0.0114 0.1135 0.5959
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0018 0.0015 1
Mycobacterium ulcerans acyl-CoA synthetase 0.0024 0.0087 0.0134
Brugia malayi hypothetical protein 0.0273 0.3008 0.4029
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0024 0.0087 0.0134
Trichomonas vaginalis ap endonuclease, putative 0.002 0.0034 0.0052
Loa Loa (eye worm) hypothetical protein 0.0046 0.0339 0.0435
Echinococcus multilocularis microtubule associated protein 2 0.0758 0.8693 0.8693
Toxoplasma gondii exonuclease III APE 0.002 0.0034 0.0295
Leishmania major hypothetical protein, conserved 0.0114 0.1135 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.0103 0.1012 0.1356
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0024 0.0087 0.0134
Brugia malayi Bromodomain containing protein 0.009 0.0852 0.1141
Mycobacterium tuberculosis Probable esterase LipL 0.0114 0.1135 0.1363
Brugia malayi Intermediate filament tail domain containing protein 0.003 0.0148 0.0199
Trichomonas vaginalis glucosylceramidase, putative 0.0174 0.1846 0.2838
Schistosoma mansoni intermediate filament proteins 0.003 0.0148 0.0171
Leishmania major 4-coumarate:coa ligase-like protein 0.0024 0.0087 0.0767
Mycobacterium ulcerans aldehyde dehydrogenase 0.0065 0.0565 0.0868
Brugia malayi latrophilin 2 splice variant baaae 0.0071 0.0629 0.0842
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0043 0.0305 0.035
Toxoplasma gondii ABC1 family protein 0.0114 0.1135 1
Loa Loa (eye worm) hypothetical protein 0.0024 0.0087 0.0097
Mycobacterium tuberculosis Conserved protein 0.0114 0.1135 0.1363
Brugia malayi AMP-binding enzyme family protein 0.0024 0.0087 0.0117
Loa Loa (eye worm) hypothetical protein 0.0071 0.0629 0.0824
Plasmodium vivax acyl-CoA synthetase, putative 0.0018 0.0015 0.0129
Leishmania major trypanothione reductase 0.0049 0.0375 0.3308
Loa Loa (eye worm) hypothetical protein 0.0084 0.0792 0.1043
Trypanosoma brucei ERV/ALR sulfhydryl oxidase domain-containing protein 0.004 0.0266 0.2345
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.0107 0.0944
Trypanosoma cruzi ISWI complex protein 0.0018 0.0015 0.0136
Mycobacterium ulcerans acyl-CoA synthetase 0.0024 0.0087 0.0134
Trypanosoma cruzi ISWI complex protein 0.0018 0.0015 0.0136
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0071 0.0638 0.0638
Trichomonas vaginalis D-aminoacylase, putative 0.0114 0.1135 0.1745
Mycobacterium leprae conserved hypothetical protein 0.0114 0.1135 0.8953
Echinococcus multilocularis musashi 0.003 0.0148 0.0148
Brugia malayi exodeoxyribonuclease III family protein 0.002 0.0034 0.0045
Trypanosoma cruzi hypothetical protein, conserved 0.0114 0.1135 1
Echinococcus granulosus FAD linked sulfhydryl oxidase ALR 0.004 0.0266 0.0306
Mycobacterium ulcerans esterase/lipase LipP 0.0114 0.1135 0.1745
Loa Loa (eye worm) hypothetical protein 0.0114 0.1135 0.1503
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0146 0.1513 0.1741
Toxoplasma gondii aldehyde dehydrogenase 0.0065 0.0565 0.4975
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.002 0.004 0.004
Echinococcus multilocularis survival motor neuron protein 1 0.0273 0.3008 0.3008
Brugia malayi Probable ATP-dependent helicase DHX35 0.0327 0.3642 0.4877
Echinococcus granulosus muscleblind protein 0.0653 0.7467 0.859
Brugia malayi AMP-binding enzyme family protein 0.0024 0.0087 0.0117
Onchocerca volvulus 0.0056 0.0455 0.2093
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0027 0.0117 0.0135
Plasmodium falciparum acyl-CoA synthetase 0.0018 0.0015 0.0392
Echinococcus multilocularis beta LACTamase domain containing family member 0.0114 0.1135 0.1135
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.003 0.0148 0.0179
Trichomonas vaginalis glucosylceramidase, putative 0.0266 0.2917 0.4486
Schistosoma mansoni hypothetical protein 0.0025 0.009 0.0104
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0146 0.1513 0.2011
Loa Loa (eye worm) hepatopoietin HPO2 0.004 0.0266 0.0337
Toxoplasma gondii Erv1 / Alr family protein 0.004 0.0266 0.2345
Schistosoma mansoni hypothetical protein 0.0033 0.0184 0.0212
Schistosoma mansoni lamin 0.003 0.0148 0.0171
Plasmodium vivax ataxin-2 like protein, putative 0.0026 0.0107 0.0944
Loa Loa (eye worm) hypothetical protein 0.0114 0.1135 0.1503
Loa Loa (eye worm) hypothetical protein 0.0114 0.1135 0.1503
Leishmania major 4-coumarate:coa ligase-like protein 0.0024 0.0087 0.0767
Schistosoma mansoni hypothetical protein 0.0071 0.0629 0.0724
Brugia malayi beta-lactamase family protein 0.0114 0.1135 0.152
Echinococcus granulosus lamin 0.003 0.0148 0.0171
Brugia malayi O-Glycosyl hydrolase family 30 protein 0.0266 0.2917 0.3907
Trichomonas vaginalis D-aminoacylase, putative 0.0114 0.1135 0.1745
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0114 0.1135 0.1503
Toxoplasma gondii LsmAD domain-containing protein 0.0026 0.0107 0.0944
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0146 0.1513 0.1741
Echinococcus multilocularis thioredoxin glutathione reductase 0.0049 0.0375 0.0375
Plasmodium vivax glutathione reductase, putative 0.0049 0.0375 0.3308
Trichomonas vaginalis ap endonuclease, putative 0.002 0.0034 0.0052
Echinococcus multilocularis zinc finger protein 0.0023 0.0075 0.0075
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0033 0.0184 0.0212
Brugia malayi hypothetical protein 0.0026 0.0107 0.0144
Plasmodium falciparum glutathione reductase 0.0049 0.0375 1
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0049 0.0375 0.0451
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0114 0.1135 0.1363
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0065 0.0565 0.0678
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.0107 0.0944
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.002 0.0034 0.0295
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0114 0.1135 0.1745
Brugia malayi beta-lactamase 0.0114 0.1135 0.152
Mycobacterium ulcerans hypothetical protein 0.0114 0.1135 0.1745
Brugia malayi Thioredoxin reductase 0.0049 0.0375 0.0503
Loa Loa (eye worm) hypothetical protein 0.003 0.0148 0.0179
Schistosoma mansoni hypothetical protein 0.0056 0.0455 0.0524
Trichomonas vaginalis glutaminase, putative 0.0571 0.6503 1
Trypanosoma brucei ISWI complex protein 0.0018 0.0015 0.0136
Trichomonas vaginalis glucosylceramidase, putative 0.0184 0.1956 0.3008
Trichomonas vaginalis penicillin-binding protein, putative 0.0114 0.1135 0.1745
Loa Loa (eye worm) thioredoxin reductase 0.0049 0.0375 0.0484
Onchocerca volvulus 0.003 0.0148 0.0349
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.002 0.0034 0.0295
Mycobacterium ulcerans aldehyde dehydrogenase 0.0065 0.0565 0.0868
Mycobacterium tuberculosis Probable hydrolase 0.0114 0.1135 0.1363
Trichomonas vaginalis glucosylceramidase, putative 0.0174 0.1846 0.2838
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.002 0.0034 0.0295
Onchocerca volvulus 0.0114 0.1135 0.5959
Plasmodium falciparum thioredoxin reductase 0.0049 0.0375 1
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0114 0.1135 0.152
Onchocerca volvulus 0.0114 0.1135 0.5959
Brugia malayi Latrophilin receptor protein 2 0.0033 0.0184 0.0247
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0146 0.1513 0.1513
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0024 0.0087 0.0105
Entamoeba histolytica acyl-CoA synthetase, putative 0.0024 0.0087 1
Plasmodium falciparum ataxin-2 like protein, putative 0.0026 0.0107 0.2855
Echinococcus multilocularis muscleblind protein 0.0653 0.7467 0.7467
Loa Loa (eye worm) DEAH box polypeptide 35 0.0327 0.3642 0.4867
Loa Loa (eye worm) hypothetical protein 0.0029 0.0142 0.0171
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0024 0.0087 0.0134
Mycobacterium tuberculosis Probable lipase LipE 0.0114 0.1135 0.1363
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0146 0.1513 0.1741
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.002 0.0034 0.0295
Loa Loa (eye worm) hypothetical protein 0.0051 0.0399 0.0515
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0112 0.1111 0.1335
Loa Loa (eye worm) hypothetical protein 0.0262 0.2875 0.3839
Echinococcus granulosus zinc finger protein 0.0023 0.0075 0.0087
Echinococcus granulosus thioredoxin glutathione reductase 0.0049 0.0375 0.0432
Loa Loa (eye worm) hypothetical protein 0.002 0.004 0.0034
Brugia malayi AMP-binding enzyme family protein 0.0024 0.0087 0.0117
Loa Loa (eye worm) hypothetical protein 0.0653 0.7467 1
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0017 0.0003 0.0004
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0124 0.1258 0.1511
Mycobacterium tuberculosis Probable lipase LipD 0.0114 0.1135 0.1363
Loa Loa (eye worm) hypothetical protein 0.0114 0.1135 0.1503
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0071 0.0638 0.0734
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0146 0.1513 0.1513
Echinococcus multilocularis FAD linked sulfhydryl oxidase ALR 0.004 0.0266 0.0266
Schistosoma mansoni methyl-cpg binding protein mbd 0.002 0.004 0.0046
Toxoplasma gondii thioredoxin reductase 0.0049 0.0375 0.3308
Loa Loa (eye worm) hypothetical protein 0.0327 0.3642 0.4867
Mycobacterium ulcerans hypothetical protein 0.0024 0.0087 0.0134
Brugia malayi beta-lactamase family protein 0.0114 0.1135 0.152
Loa Loa (eye worm) hypothetical protein 0.0049 0.0372 0.0479
Loa Loa (eye worm) hypothetical protein 0.0273 0.3008 0.4017
Trichomonas vaginalis glucosylceramidase, putative 0.0174 0.1846 0.2838
Plasmodium falciparum ataxin-2 like protein, putative 0.0026 0.0107 0.2855
Trichomonas vaginalis glucosylceramidase, putative 0.0174 0.1846 0.2838
Loa Loa (eye worm) hypothetical protein 0.0114 0.1135 0.1503
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0124 0.1258 0.1511
Schistosoma mansoni zinc finger protein 0.0018 0.0015 0.0018
Trichomonas vaginalis glucosylceramidase, putative 0.0266 0.2917 0.4486
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0033 0.0184 0.0184
Leishmania major 4-coumarate:coa ligase-like protein 0.0024 0.0087 0.0767
Brugia malayi intermediate filament protein 0.003 0.0148 0.0199
Mycobacterium tuberculosis Conserved protein 0.0114 0.1135 0.1363
Echinococcus granulosus methyl CpG binding domain protein 2 0.002 0.004 0.0046
Entamoeba histolytica acyl-CoA synthetase, putative 0.0024 0.0087 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.002 0.004 0.0046
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0191 0.2047 0.2355
Leishmania major hypothetical protein, conserved 0.0018 0.0015 0.0136
Trypanosoma brucei hypothetical protein, conserved 0.0114 0.1135 1
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0018 0.0015 0.0018
Leishmania major hypothetical protein, conserved 0.0026 0.0107 0.0944
Mycobacterium leprae Probable lipase LipE 0.0114 0.1135 0.8953
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0726 0.8324 1
Schistosoma mansoni ap endonuclease 0.002 0.0034 0.0039
Brugia malayi Muscleblind-like protein 0.0653 0.7467 1
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.002 0.0034 0.004
Schistosoma mansoni microtubule-associated protein tau 0.0758 0.8693 1
Brugia malayi Augmenter of liver regeneration 0.004 0.0266 0.0357
Schistosoma mansoni glutaminase 0.0571 0.6503 0.748
Echinococcus multilocularis methyl CpG binding domain protein 2 0.002 0.004 0.004
Loa Loa (eye worm) hypothetical protein 0.0653 0.7467 1
Mycobacterium tuberculosis Conserved protein 0.0114 0.1135 0.1363
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.002 0.0034 0.0034
Schistosoma mansoni aldehyde dehydrogenase 0.0065 0.0565 0.0649
Loa Loa (eye worm) hypothetical protein 0.0024 0.0087 0.0097
Mycobacterium ulcerans lipase LipD 0.0114 0.1135 0.1745
Trichomonas vaginalis glucosylceramidase, putative 0.0184 0.1956 0.3008
Echinococcus multilocularis muscleblind protein 1 0.0653 0.7467 0.7467
Trichomonas vaginalis glucosylceramidase, putative 0.0174 0.1846 0.2838
Onchocerca volvulus Glucosylceramidase homolog 0.0174 0.1846 1
Echinococcus granulosus microtubule associated protein 2 0.0758 0.8693 1
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0191 0.2047 0.2047
Trichomonas vaginalis glucosylceramidase, putative 0.0266 0.2917 0.4486
Trichomonas vaginalis glucosylceramidase, putative 0.0266 0.2917 0.4486
Plasmodium vivax FAD-linked sulfhydryl oxidase ERV1, putative 0.004 0.0266 0.2345
Trichomonas vaginalis esterase, putative 0.0114 0.1135 0.1745
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.002 0.0034 1
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0043 0.0305 0.0305
Mycobacterium ulcerans beta-lactamase 0.0114 0.1135 0.1745
Leishmania major hypothetical protein, conserved 0.004 0.0266 0.2345
Schistosoma mansoni zinc finger protein 0.0023 0.0075 0.0087
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.0266 0.2917 0.3895
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.002 0.0034 0.0052
Echinococcus multilocularis lamin dm0 0.003 0.0148 0.0148
Schistosoma mansoni lamin 0.003 0.0148 0.0171
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.002 0.0034 0.0893
Loa Loa (eye worm) hypothetical protein 0.0024 0.0087 0.0097
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.002 0.0034 1
Mycobacterium ulcerans acyl-CoA synthetase 0.0024 0.0087 0.0134
Schistosoma mansoni bromodomain containing protein 0.0076 0.0688 0.0791
Schistosoma mansoni hypothetical protein 0.0033 0.0184 0.0212
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0065 0.0565 0.0649
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0018 0.0015 0.0023
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0017 0.0003 0.0004
Schistosoma mansoni methyl-cpg binding protein mbd 0.002 0.004 0.0046

Activities

Activity type Activity value Assay description Source Reference
Ki (binding) = 0.7 nM Displacement of [125I][Sar1,Ile8]Ang2 from wild-type human AT1 receptor expressed in CHO cells by gamma counting ChEMBL. 20146480

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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