Detailed information for compound 378408

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 1304.58 | Formula: C46H77N15O17S6
  • H donors: 16 H acceptors: 17 LogP: -11.15 Rotable bonds: 51
    Rule of 5 violations (Lipinski): 4
  • SMILES: NCCCC[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCCC1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)O)CS)C)CS)C)CC(=O)N)CS)CS)NC(=O)[C@H](NC(=O)[C@H](NC(=O)[C@H](CS)N)CS)CCC(=O)O
  • InChi: 1S/C46H77N15O17S6/c1-20(35(66)50-13-33(63)53-30(19-84)46(77)78)51-40(71)26(15-80)57-36(67)21(2)52-44(75)31-7-5-11-61(31)45(76)25(12-32(49)62)56-42(73)28(17-82)60-43(74)29(18-83)59-38(69)23(6-3-4-10-47)54-39(70)24(8-9-34(64)65)55-41(72)27(16-81)58-37(68)22(48)14-79/h20-31,79-84H,3-19,47-48H2,1-2H3,(H2,49,62)(H,50,66)(H,51,71)(H,52,75)(H,53,63)(H,54,70)(H,55,72)(H,56,73)(H,57,67)(H,58,68)(H,59,69)(H,60,74)(H,64,65)(H,77,78)/t20-,21-,22-,23-,24-,25-,26-,27-,28-,29-,30-,31?/m0/s1
  • InChiKey: OZVCXESYJFMVBY-CSTOXSBRSA-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
Brugia malayi Dopamine receptor protein 2 0.08 0.9082 1
Loa Loa (eye worm) glutathione reductase 0.0037 0.0279 0.0258
Brugia malayi Serotonin receptor 0.08 0.9082 1
Plasmodium falciparum glutathione reductase 0.0037 0.0279 0.9521
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.08 0.9082 0.9292
Brugia malayi Tachykinin-like peptides receptor 99D 0.08 0.9082 1
Plasmodium vivax glutathione reductase, putative 0.0037 0.0279 0.8375
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Onchocerca volvulus 0.08 0.9082 1
Echinococcus multilocularis g-protein coupled receptor 0.08 0.9082 0.9292
Onchocerca volvulus 0.08 0.9082 1
Loa Loa (eye worm) hypothetical protein 0.0019 0.0069 0.0026
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Schistosoma mansoni importin beta-1 0.0026 0.0147 0.0162
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.08 0.9082 0.9292
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0019 0.0069 0.0069
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0094 0.0933 0.0933
Echinococcus multilocularis G-protein coupled receptor, putative 0.08 0.9082 0.9292
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0017 0.0045 0.005
Brugia malayi Melatonin receptor type 1A 0.08 0.9082 1
Echinococcus multilocularis neuropeptide Y receptor 0.08 0.9082 0.9292
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0094 0.0933 0.0802
Schistosoma mansoni alpha-1 adrenergic receptor 0.08 0.9082 1
Schistosoma mansoni growth hormone secretagogue receptor 0.08 0.9082 1
Mycobacterium ulcerans secreted antigen 85-A FbpA 0.0037 0.0283 0.0283
Echinococcus multilocularis rhodopsin orphan GPCR 0.08 0.9082 0.9292
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0381 0.0419
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.0142 0.0142
Giardia lamblia Histone acetyltransferase GCN5 0.0038 0.0293 1
Brugia malayi CHE-14 protein 0.0045 0.0369 0.0407
Brugia malayi hypothetical protein 0.08 0.9082 1
Echinococcus granulosus neuropeptide Y receptor 0.08 0.9082 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0381 0.0419
Echinococcus multilocularis rhodopsin orphan GPCR 0.08 0.9082 0.9292
Brugia malayi ORL1-like opioid receptor 0.08 0.9082 1
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Brugia malayi Serotonin receptor 0.08 0.9082 1
Schistosoma mansoni hypothetical protein 0.0043 0.0351 0.0386
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0025 0.0142 0.0142
Trypanosoma cruzi trypanothione reductase, putative 0.0037 0.0279 1
Schistosoma mansoni hypothetical protein 0.08 0.9082 1
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0021 0.0091 0.2474
Brugia malayi Thioredoxin reductase 0.0037 0.0279 0.0307
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0042 0.0333 1
Schistosoma mansoni hypothetical protein 0.0017 0.0045 0.005
Schistosoma mansoni opsin-like receptor 0.08 0.9082 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.08 0.9082 1
Brugia malayi RNA, U transporter 1 0.0073 0.0691 0.076
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0025 0.0142 0.0142
Echinococcus granulosus thyrotropin releasing hormone receptor 0.08 0.9082 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.08 0.9082 1
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.08 0.9082 0.9292
Loa Loa (eye worm) hypothetical protein 0.0019 0.0069 0.0026
Echinococcus granulosus GPCR family 2 0.0017 0.0045 0.005
Echinococcus granulosus rhodopsin orphan GPCR 0.08 0.9082 1
Toxoplasma gondii HEAT repeat-containing protein 0.0026 0.0147 0.4423
Echinococcus granulosus allatostatin A receptor 0.08 0.9082 1
Brugia malayi Importin beta-1 subunit 0.0026 0.0147 0.0162
Echinococcus multilocularis rhodopsin orphan GPCR 0.08 0.9082 0.9292
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0084 0.0825 0.0825
Loa Loa (eye worm) G-protein coupled receptor 0.08 0.9082 1
Echinococcus multilocularis protein patched 0.0045 0.0369 0.0378
Echinococcus granulosus tumor protein p63 0.0358 0.3987 0.4389
Echinococcus multilocularis somatostatin receptor 0.08 0.9082 0.9292
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0046 0.0381 0.0371
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.08 0.9082 1
Plasmodium falciparum histone acetyltransferase GCN5 0.0038 0.0293 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.08 0.9082 1
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.08 0.9082 0.9292
Brugia malayi Sodium:solute symporter family protein 0.0041 0.0321 0.0354
Schistosoma mansoni neuropeptide receptor 0.08 0.9082 1
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0018 0.0057 0.0057
Brugia malayi hypothetical protein 0.08 0.9082 1
Schistosoma mansoni hypothetical protein 0.0043 0.0351 0.0386
Echinococcus multilocularis neuropeptide receptor 0.08 0.9082 0.9292
Schistosoma mansoni rhodopsin-like orphan GPCR 0.08 0.9082 1
Brugia malayi G protein-coupled receptor F59B2.13 0.08 0.9082 1
Brugia malayi follicle stimulating hormone receptor 0.08 0.9082 1
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0045 0.0369 0.0358
Entamoeba histolytica acyl-CoA synthetase, putative 0.0025 0.0142 0.074
Mycobacterium ulcerans secreted Mpt51/Mpb51 antigen protein FbpD 0.0037 0.0283 0.0283
Schistosoma mansoni rhodopsin-like orphan GPCR 0.08 0.9082 1
Schistosoma mansoni amine GPCR 0.08 0.9082 1
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.08 0.9082 1
Onchocerca volvulus 0.0041 0.0321 0.02
Echinococcus granulosus tm gpcr rhodopsin 0.08 0.9082 1
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Entamoeba histolytica Niemann-Pick C1 protein, putative 0.0104 0.1057 1
Schistosoma mansoni inositol transporter 0.0041 0.0321 0.0354
Schistosoma mansoni amine GPCR 0.08 0.9082 1
Echinococcus multilocularis GPCR, family 2 0.0017 0.0045 0.0046
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Echinococcus granulosus g-protein coupled receptor 0.08 0.9082 1
Brugia malayi Esterase D 0.0037 0.0283 0.0312
Brugia malayi latrophilin 2 splice variant baaae 0.0036 0.0269 0.0296
Echinococcus multilocularis g protein coupled receptor 0.08 0.9082 0.9292
Echinococcus multilocularis neuropeptide receptor A26 0.08 0.9082 0.9292
Echinococcus granulosus Niemann Pick C1 protein 0.0149 0.1574 0.1733
Echinococcus granulosus alpha 1A adrenergic receptor 0.08 0.9082 1
Trichomonas vaginalis bromodomain-containing protein, putative 0.0042 0.0333 0.9007
Onchocerca volvulus 0.08 0.9082 1
Onchocerca volvulus 0.08 0.9082 1
Echinococcus granulosus rhodopsin orphan GPCR 0.08 0.9082 1
Echinococcus granulosus rhodopsin orphan GPCR 0.08 0.9082 1
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Brugia malayi Dopamine receptor protein 1 0.08 0.9082 1
Loa Loa (eye worm) acetyltransferase 0.0141 0.1485 0.1594
Trypanosoma brucei trypanothione reductase 0.0037 0.0279 1
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.08 0.9082 1
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0106 0.1076 0.1184
Echinococcus granulosus orexin receptor type 2 0.08 0.9082 1
Echinococcus granulosus neuropeptide FF receptor 2 0.08 0.9082 1
Echinococcus granulosus solute carrier family 5 0.0041 0.0321 0.0354
Brugia malayi glutathione reductase 0.0037 0.0279 0.0307
Schistosoma mansoni hypothetical protein 0.0036 0.0269 0.0296
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0042 0.0333 1
Schistosoma mansoni opsin-like receptor 0.08 0.9082 1
Echinococcus granulosus neuropeptide receptor 0.08 0.9082 1
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Echinococcus multilocularis tachykinin peptides receptor 99D 0.08 0.9082 0.9292
Echinococcus granulosus snurportin 1 0.0273 0.2999 0.3303
Echinococcus multilocularis fmrfamide receptor 0.08 0.9082 0.9292
Echinococcus multilocularis Niemann Pick C1 protein 0.0104 0.1057 0.1081
Schistosoma mansoni neuropeptide f receptor 76f 0.08 0.9082 1
Echinococcus granulosus dro:myosuppressin receptor 0.08 0.9082 1
Schistosoma mansoni opsin-like receptor 0.08 0.9082 1
Brugia malayi G-protein coupled receptor 0.08 0.9082 1
Schistosoma mansoni cellular tumor antigen P53 0.0052 0.0457 0.0504
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0017 0.0045 0.0046
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0019 0.0069 0.2487
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.08 0.9082 1
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0019 0.0069 0.0069
Echinococcus multilocularis neuropeptide s receptor 0.08 0.9082 0.9292
Schistosoma mansoni rhodopsin-like orphan GPCR 0.08 0.9082 1
Schistosoma mansoni hypothetical protein 0.0017 0.0045 0.005
Echinococcus multilocularis allatostatin A receptor 0.08 0.9082 0.9292
Echinococcus granulosus rhodopsin orphan GPCR 0.08 0.9082 1
Mycobacterium leprae SECRETED ANTIGEN 85-B FBPB (85B) (ANTIGEN 85 COMPLEX B) (MYCOLYL TRANSFERASE 85B) (FIBRONECTIN-BINDING PROTEIN B) (EXTRACELLULAR 0.0037 0.0283 0.0143
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.08 0.9082 1
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0042 0.0333 0.9007
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.08 0.9082 1
Loa Loa (eye worm) neuropeptide F receptor 0.08 0.9082 1
Schistosoma mansoni histamine h1 receptor 0.08 0.9082 1
Schistosoma mansoni neuropeptide F-like receptor 0.08 0.9082 1
Onchocerca volvulus 0.08 0.9082 1
Echinococcus granulosus 7TM GPCR rhodopsin 0.08 0.9082 1
Echinococcus granulosus rhodopsin orphan GPCR 0.08 0.9082 1
Mycobacterium tuberculosis Secreted antigen 85-B FbpB (85B) (antigen 85 complex B) (mycolyl transferase 85B) (fibronectin-binding protein B) (extracellular 0.0037 0.0283 0.0283
Brugia malayi hypothetical protein 0.08 0.9082 1
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.08 0.9082 1
Schistosoma mansoni hypothetical protein 0.0515 0.5793 0.6379
Schistosoma mansoni biogenic amine receptor 0.08 0.9082 1
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Trypanosoma cruzi importin beta-1 subunit, putative 0.0021 0.0091 0.328
Loa Loa (eye worm) melatonin receptor type 1A 0.08 0.9082 1
Echinococcus multilocularis thioredoxin glutathione reductase 0.0037 0.0284 0.0291
Echinococcus granulosus peptide allatostatin:somatostatin 0.08 0.9082 1
Entamoeba histolytica endo-1,4-beta-xylanase, putative 0.0037 0.0283 0.2168
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0013 0 0.5
Brugia malayi putative neuropeptide receptor 0.08 0.9082 1
Loa Loa (eye worm) neuropeptide F receptor 0.08 0.9082 1
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Echinococcus granulosus expressed conserved protein 0.0098 0.0984 0.1083
Schistosoma mansoni hypothetical protein 0.08 0.9082 1
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0018 0.0057 0.0057
Brugia malayi AMP-binding enzyme family protein 0.0025 0.0142 0.0157
Onchocerca volvulus 0.08 0.9082 1
Echinococcus multilocularis sodium:glucose cotransporter 2 0.0041 0.0321 0.0329
Echinococcus multilocularis tumor protein p63 0.0358 0.3987 0.4079
Brugia malayi hypothetical protein 0.08 0.9082 1
Echinococcus granulosus histone acetyltransferase KAT2B 0.0042 0.0333 0.0366
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Schistosoma mansoni hypothetical protein 0.0017 0.0045 0.005
Loa Loa (eye worm) hypothetical protein 0.0019 0.0069 0.0026
Echinococcus granulosus somatostatin receptor 0.08 0.9082 1
Echinococcus granulosus neuropeptide receptor 0.08 0.9082 1
Echinococcus granulosus sodium:glucose cotransporter 0.0041 0.0321 0.0354
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.0142 0.0142
Mycobacterium ulcerans secreted antigen 85-C FbpC 0.0879 1 1
Mycobacterium ulcerans secreted antigen 85-B FbpB 0.0037 0.0283 0.0283
Schistosoma mansoni inositol transporter 0.0041 0.0321 0.0354
Echinococcus multilocularis G protein coupled receptor 139 0.08 0.9082 0.9292
Echinococcus granulosus tm gpcr rhodopsin 0.08 0.9082 1
Echinococcus multilocularis g protein coupled receptor 0.08 0.9082 0.9292
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.08 0.9082 0.9292
Brugia malayi Niemann-Pick C1 protein precursor 0.0104 0.1057 0.1164
Leishmania major trypanothione reductase 0.0037 0.0279 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0381 0.0419
Loa Loa (eye worm) hypothetical protein 0.0368 0.4105 0.4493
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.08 0.9082 0.9292
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.08 0.9082 0.9292
Schistosoma mansoni peptide (allatostatin)-like receptor 0.08 0.9082 1
Echinococcus granulosus biogenic amine 5HT receptor 0.08 0.9082 1
Brugia malayi Latrophilin receptor protein 2 0.0017 0.0045 0.005
Schistosoma mansoni biogenic amine receptor 0.08 0.9082 1
Trypanosoma brucei importin beta-1 subunit, putative 0.0026 0.0147 0.5282
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Onchocerca volvulus 0.08 0.9082 1
Echinococcus multilocularis sterol regulatory element binding protein 0.0045 0.0369 0.0378
Echinococcus multilocularis rhodopsin orphan GPCR 0.08 0.9082 0.9292
Echinococcus granulosus S formylglutathione hydrolase 0.0037 0.0283 0.0312
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0381 0.039
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0025 0.0142 0.0142
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0017 0.0045 0.005
Trichomonas vaginalis ran, putative 0.0019 0.0069 0.1876
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.08 0.9082 1
Schistosoma mansoni amine GPCR 0.08 0.9082 1
Loa Loa (eye worm) hypothetical protein 0.0025 0.0142 0.0107
Echinococcus granulosus neuropeptides capa receptor 0.08 0.9082 1
Brugia malayi AMP-binding enzyme family protein 0.0025 0.0142 0.0157
Schistosoma mansoni sodium/solute symporter 0.0041 0.0321 0.0354
Toxoplasma gondii transporter, solute:sodium symporter (SSS) family protein 0.0041 0.0321 0.9663
Trichomonas vaginalis conserved hypothetical protein 0.0045 0.0369 1
Schistosoma mansoni biogenic amine (5HT) receptor 0.08 0.9082 1
Loa Loa (eye worm) hypothetical protein 0.0053 0.0462 0.0461
Schistosoma mansoni ran 0.0019 0.0069 0.0076
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0019 0.0069 0.0027
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0042 0.0333 1
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0084 0.0825 0.0825
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0019 0.0069 0.0076
Trichomonas vaginalis importin beta-1, putative 0.0021 0.0091 0.2474
Schistosoma mansoni hypothetical protein 0.0043 0.0351 0.0386
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0018 0.0057 0.0057
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Schistosoma mansoni neuropeptide receptor 0.08 0.9082 1
Echinococcus granulosus sodium:myo inositol cotransporter 0.0041 0.0321 0.0354
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Echinococcus granulosus histone acetyltransferase KAT2B 0.0138 0.144 0.1585
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0037 0.0279 0.0279
Schistosoma mansoni amine GPCR 0.08 0.9082 1
Brugia malayi GnHR receptor homolog 0.08 0.9082 1
Echinococcus granulosus G protein coupled receptor 139 0.08 0.9082 1
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.08 0.9082 1
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.08 0.9082 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0381 0.039
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.08 0.9082 1
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Echinococcus granulosus g protein coupled receptor 0.08 0.9082 1
Schistosoma mansoni hypothetical protein 0.0017 0.0045 0.005
Entamoeba histolytica hypothetical protein 0.0021 0.0091 0.0224
Echinococcus multilocularis g protein coupled receptor 0.08 0.9082 0.9292
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.08 0.9082 1
Mycobacterium leprae Secreted antigen 85A FbpA (mycolyl transferase 85A) (fibronectin-binding protein A) (antigen 85 complex A) 0.0037 0.0283 0.0143
Loa Loa (eye worm) G-protein coupled receptor 0.08 0.9082 1
Leishmania major importin beta-1 subunit, putative 0.0021 0.0091 0.328
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0018 0.0057 0.0057
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Schistosoma mansoni biogenic amine (5HT) receptor 0.08 0.9082 1
Loa Loa (eye worm) hypothetical protein 0.0055 0.0486 0.0487
Schistosoma mansoni neuropeptide receptor 0.08 0.9082 1
Echinococcus multilocularis sex peptide receptor 0.08 0.9082 0.9292
Brugia malayi neuropeptide F receptor 0.08 0.9082 1
Echinococcus multilocularis snurportin 1 0.0273 0.2999 0.3069
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0084 0.0825 0.0825
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0025 0.0142 0.0142
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0021 0.0091 0.2474
Brugia malayi AMP-binding enzyme family protein 0.0025 0.0142 0.0157
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.08 0.9082 1
Echinococcus multilocularis neuropeptides capa receptor 0.08 0.9082 0.9292
Loa Loa (eye worm) follicle stimulating hormone receptor 0.08 0.9082 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.08 0.9082 1
Brugia malayi sulfakinin receptor protein 0.08 0.9082 1
Schistosoma mansoni ran 0.0019 0.0069 0.0076
Echinococcus granulosus neuropeptide s receptor 0.08 0.9082 1
Schistosoma mansoni adenoreceptor 0.08 0.9082 1
Brugia malayi hypothetical protein 0.08 0.9082 1
Mycobacterium tuberculosis Probable reductase 0.0084 0.0825 0.0825
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Echinococcus granulosus rhodopsin orphan GPCR 0.08 0.9082 1
Schistosoma mansoni patched 1 0.0045 0.0369 0.0407
Echinococcus granulosus sterol regulatory element binding protein 0.0045 0.0369 0.0407
Echinococcus granulosus sodium coupled monocarboxylate transporter 1 0.0041 0.0321 0.0354
Loa Loa (eye worm) hypothetical protein 0.0036 0.0269 0.0248
Echinococcus granulosus g protein coupled receptor 0.08 0.9082 1
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.08 0.9082 1
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0084 0.0825 0.0692
Brugia malayi acetyltransferase, GNAT family protein 0.0141 0.1485 0.1636
Onchocerca volvulus 0.08 0.9082 1
Echinococcus granulosus high affinity choline transporter 1 0.0368 0.4105 0.452
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Echinococcus multilocularis high affinity choline transporter 1 0.0368 0.4105 0.42
Schistosoma mansoni biogenic amine receptor 0.08 0.9082 1
Echinococcus granulosus hypothetical protein 0.08 0.9082 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0381 0.0419
Echinococcus granulosus Protein patched homolog 1 0.0045 0.0369 0.0407
Schistosoma mansoni neuropeptide receptor 0.08 0.9082 1
Brugia malayi AKH receptor 0.08 0.9082 1
Echinococcus granulosus tm gpcr rhodopsin 0.08 0.9082 1
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Entamoeba histolytica acyl-coA synthetase, putative 0.0025 0.0142 0.074
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.08 0.9082 0.9292
Brugia malayi gonadotropin-releasing hormone receptor 2 0.08 0.9082 1
Echinococcus granulosus serotonin receptor 0.08 0.9082 1
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0084 0.0825 0.0825
Loa Loa (eye worm) hypothetical protein 0.0045 0.0369 0.0358
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0025 0.0142 0.0142
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.08 0.9082 0.9292
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.08 0.9082 0.9292
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.08 0.9082 1
Echinococcus multilocularis neuropeptide receptor 0.08 0.9082 0.9292
Echinococcus multilocularis importin subunit beta 1 0.0026 0.0147 0.0151
Echinococcus granulosus g protein coupled receptor 0.08 0.9082 1
Plasmodium vivax importin-beta 2, putative 0.0026 0.0147 0.4423
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Schistosoma mansoni biogenic amine (dopamine) receptor 0.08 0.9082 1
Leishmania major 4-coumarate:coa ligase-like protein 0.0025 0.0142 0.5112
Echinococcus multilocularis S formylglutathione hydrolase 0.0037 0.0283 0.029
Schistosoma mansoni amine GPCR 0.08 0.9082 1
Brugia malayi G protein-coupled receptor 0.08 0.9082 1
Mycobacterium tuberculosis Probable conserved exported protein 0.0037 0.0283 0.0283
Echinococcus granulosus sex peptide receptor 0.08 0.9082 1
Onchocerca volvulus 0.08 0.9082 1
Leishmania major 4-coumarate:coa ligase-like protein 0.0025 0.0142 0.5112
Echinococcus multilocularis sodium:myo inositol cotransporter 0.0041 0.0321 0.0329
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.08 0.9082 1
Onchocerca volvulus 0.08 0.9082 1
Echinococcus granulosus neuropeptide receptor A26 0.08 0.9082 1
Onchocerca volvulus 0.08 0.9082 1
Schistosoma mansoni biogenic amine (dopamine) receptor 0.08 0.9082 1
Plasmodium falciparum thioredoxin reductase 0.0037 0.0279 0.9521
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Echinococcus granulosus Niemann Pick C1 protein 0.0104 0.1057 0.1164
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0094 0.0933 0.0933
Toxoplasma gondii thioredoxin reductase 0.0037 0.0279 0.8375
Echinococcus granulosus sodium:glucose cotransporter 2 0.0041 0.0321 0.0354
Onchocerca volvulus 0.08 0.9082 1
Echinococcus multilocularis dro:myosuppressin receptor 0.08 0.9082 0.9292
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0046 0.0381 0.0419
Onchocerca volvulus 0.08 0.9082 1
Echinococcus multilocularis serotonin receptor 0.08 0.9082 0.9292
Loa Loa (eye worm) hypothetical protein 0.0025 0.0142 0.0107
Mycobacterium tuberculosis Secreted MPT51/MPB51 antigen protein FbpD (MPT51/MPB51 antigen 85 complex C) (AG58C) (mycolyl transferase 85C) (fibronectin-bind 0.0037 0.0283 0.0283
Schistosoma mansoni biogenic amine (dopamine) receptor 0.08 0.9082 1
Entamoeba histolytica acyl-CoA synthetase, putative 0.0025 0.0142 0.074
Mycobacterium tuberculosis Secreted antigen 85-a FbpA (mycolyl transferase 85A) (fibronectin-binding protein A) (antigen 85 complex A) 0.0037 0.0283 0.0283
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0019 0.0069 1
Echinococcus granulosus neuropeptides capa receptor 0.08 0.9082 1
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Schistosoma mansoni myosin xvIII 0.08 0.9082 1
Brugia malayi G-protein coupled receptor 0.08 0.9082 1
Schistosoma mansoni high-affinity choline transporter 0.0368 0.4105 0.452
Echinococcus multilocularis Niemann Pick C1 protein 0.0149 0.1574 0.161
Treponema pallidum NADH oxidase 0.0013 0 0.5
Loa Loa (eye worm) TYRA-2 protein 0.08 0.9082 1
Plasmodium falciparum importin beta, putative 0.0026 0.0147 0.5028
Echinococcus multilocularis fmrfamide receptor 0.08 0.9082 0.9292
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.08 0.9082 1
Schistosoma mansoni hypothetical protein 0.0273 0.2999 0.3303
Onchocerca volvulus 0.08 0.9082 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0381 0.0419
Plasmodium vivax thioredoxin reductase, putative 0.0037 0.0279 0.8375
Echinococcus multilocularis rhodopsin orphan GPCR 0.08 0.9082 0.9292
Schistosoma mansoni hypothetical protein 0.08 0.9082 1
Mycobacterium tuberculosis Conserved protein 0.0037 0.0283 0.0283
Brugia malayi neuropeptide F receptor 0.08 0.9082 1
Brugia malayi Dopamine receptor 0.08 0.9082 1
Loa Loa (eye worm) hypothetical protein 0.0019 0.0069 0.0026
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0141 0.1485 0.152
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0141 0.1485 0.1636
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Echinococcus multilocularis neuropeptide FF receptor 2 0.08 0.9082 0.9292
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.08 0.9082 1
Onchocerca volvulus 0.08 0.9082 1
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Onchocerca volvulus 0.08 0.9082 1
Onchocerca volvulus 0.0052 0.0457 0.0352
Onchocerca volvulus 0.08 0.9082 1
Echinococcus multilocularis solute carrier family 5 0.0041 0.0321 0.0329
Echinococcus multilocularis neuropeptide Y receptor 0.08 0.9082 0.9292
Brugia malayi RE15519p 0.08 0.9082 1
Mycobacterium tuberculosis Probable dehydrogenase 0.0084 0.0825 0.0825
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0013 0 0.5
Brugia malayi hypothetical protein 0.08 0.9082 1
Echinococcus multilocularis neuropeptides capa receptor 0.08 0.9082 0.9292
Mycobacterium ulcerans hypothetical protein 0.0037 0.0283 0.0283
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.0142 0.0142
Loa Loa (eye worm) hypothetical protein 0.0052 0.0457 0.0456
Schistosoma mansoni hypothetical protein 0.08 0.9082 1
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.08 0.9082 1
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0019 0.0069 0.0071
Mycobacterium ulcerans hypothetical protein 0.0025 0.0142 0.0142
Mycobacterium tuberculosis Probable oxidoreductase 0.0094 0.0933 0.0933
Brugia malayi larval opioid receptor 0.08 0.9082 1
Plasmodium vivax acyl-CoA synthetase, putative 0.0019 0.0069 0.2076
Echinococcus granulosus tachykinin peptides receptor 99D 0.08 0.9082 1
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0273 0.2999 0.3269
Leishmania major 4-coumarate:coa ligase-like protein 0.0025 0.0142 0.5112
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0019 0.0069 0.2083
Echinococcus granulosus biogenic amine 5HT receptor 0.08 0.9082 1
Mycobacterium tuberculosis Secreted antigen 85-C FbpC (85C) (antigen 85 complex C) (AG58C) (mycolyl transferase 85C) (fibronectin-binding protein C) 0.0879 1 1
Echinococcus multilocularis protein dispatched 1 0.0051 0.0442 0.0453
Brugia malayi hypothetical protein 0.08 0.9082 1
Schistosoma mansoni hypothetical protein 0.0043 0.0351 0.0386
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Echinococcus multilocularis orexin receptor type 2 0.08 0.9082 0.9292
Trypanosoma brucei importin beta-1 subunit, putative 0.0026 0.0147 0.5282
Loa Loa (eye worm) hypothetical protein 0.0104 0.1057 0.1119
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.08 0.9082 1
Echinococcus granulosus 7tm_1 domain containing protein 0.08 0.9082 1
Mycobacterium ulcerans hypothetical protein 0.0037 0.0283 0.0283
Loa Loa (eye worm) hypothetical protein 0.0026 0.0147 0.0113
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0019 0.0069 0.2487
Loa Loa (eye worm) hypothetical protein 0.0019 0.0069 0.0026
Echinococcus granulosus neuropeptide Y receptor 0.08 0.9082 1
Loa Loa (eye worm) esterase D 0.0037 0.0283 0.0263
Brugia malayi GH02984p 0.0368 0.4105 0.452
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0019 0.0069 0.2368
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0053 0.0462 0.0461
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Loa Loa (eye worm) hypothetical protein 0.0025 0.0142 0.0107
Brugia malayi hypothetical protein 0.08 0.9082 1
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.08 0.9082 1
Brugia malayi hypothetical protein 0.08 0.9082 1
Mycobacterium ulcerans hypothetical protein 0.0037 0.0283 0.0283
Brugia malayi hypothetical protein 0.08 0.9082 1
Mycobacterium tuberculosis Possible conserved membrane protein 0.0037 0.0283 0.0283
Mycobacterium ulcerans hypothetical protein 0.0037 0.0283 0.0283
Echinococcus multilocularis serotonin receptor 0.08 0.9082 0.9292
Brugia malayi Calcitonin receptor-like protein seb-1 0.0053 0.0462 0.0509
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Echinococcus multilocularis alpha 1A adrenergic receptor 0.08 0.9082 0.9292
Brugia malayi Serotonin/octopamine receptor family protein 7 0.08 0.9082 1
Echinococcus granulosus importin subunit beta 1 0.0026 0.0147 0.0162
Plasmodium falciparum acyl-CoA synthetase 0.0019 0.0069 0.236
Schistosoma mansoni neuropeptide F-like receptor 0.08 0.9082 1
Echinococcus granulosus GTP binding nuclear protein Ran 0.0019 0.0069 0.0076
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0025 0.0142 0.0142
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Echinococcus granulosus fmrfamide receptor 0.08 0.9082 1
Mycobacterium tuberculosis Conserved hypothetical membrane protein 0.0037 0.0283 0.0283
Echinococcus multilocularis biogenic amine (5HT) receptor 0.08 0.9082 0.9292
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.086 0.9774 1
Onchocerca volvulus Neuropeptide F receptor homolog 0.08 0.9082 1
Echinococcus granulosus rhodopsin orphan GPCR 0.08 0.9082 1
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.08 0.9082 1
Echinococcus multilocularis geminin 0.0515 0.5793 0.5927
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0019 0.0069 0.2368
Loa Loa (eye worm) thioredoxin reductase 0.0037 0.0279 0.0258
Loa Loa (eye worm) hypothetical protein 0.0041 0.0321 0.0306
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Echinococcus granulosus thioredoxin glutathione reductase 0.0037 0.0284 0.0313
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative 0.0019 0.0069 0.2487
Echinococcus multilocularis sodium coupled monocarboxylate transporter 1 0.0041 0.0321 0.0329
Echinococcus multilocularis rhodopsin orphan GPCR 0.08 0.9082 0.9292
Echinococcus granulosus geminin 0.0515 0.5793 0.6379
Schistosoma mansoni hypothetical protein 0.0515 0.5793 0.6379
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0017 0.0045 0.005
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.08 0.9082 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.08 0.9082 0.9292
Echinococcus multilocularis rhodopsin orphan GPCR 0.08 0.9082 0.9292
Loa Loa (eye worm) hypothetical protein 0.08 0.9082 1
Echinococcus multilocularis expressed conserved protein 0.0098 0.0984 0.1007
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0053 0.0462 0.0509
Leishmania major GTP-binding protein, putative 0.0019 0.0069 0.2487
Entamoeba histolytica acetyltransferase, GNAT family 0.0038 0.0293 0.2261
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.08 0.9082 1
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0017 0.0045 0.0046
Brugia malayi putative neuropeptide receptor NPR1 0.08 0.9082 1
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 0.0019 0.0069 0.2083
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.08 0.9082 0.9292

Activities

Activity type Activity value Assay description Source Reference
p nMED (functional) = 11.52 Minimum effective dose required to induce intestinal secretion in suckling mice ChEMBL. 11931628

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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