Detailed information for compound 1986880

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 1045.2 | Formula: C49H72N16O10
  • H donors: 15 H acceptors: 10 LogP: -3.83 Rotable bonds: 23
    Rule of 5 violations (Lipinski): 3
  • SMILES: NCCC[C@@H]1NC(=O)[C@H](CCC(=O)NCCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC1=O)Cc1ccccc1)CCCNC(=N)N)Cc1c[nH]c2c1cccc2)C(=O)O)NC(=O)[C@@H](NC(=O)C)CCCNC(=N)N
  • InChi: 1S/C49H72N16O10/c1-28(66)59-33(16-8-23-56-48(51)52)41(68)62-36-19-20-40(67)55-22-10-18-37(47(74)75)63-46(73)39(26-30-27-58-32-14-6-5-13-31(30)32)65-43(70)35(17-9-24-57-49(53)54)61-45(72)38(25-29-11-3-2-4-12-29)64-42(69)34(15-7-21-50)60-44(36)71/h2-6,11-14,27,33-39,58H,7-10,15-26,50H2,1H3,(H,55,67)(H,59,66)(H,60,71)(H,61,72)(H,62,68)(H,63,73)(H,64,69)(H,65,70)(H,74,75)(H4,51,52,56)(H4,53,54,57)/t33-,34-,35-,36-,37-,38+,39-/m0/s1
  • InChiKey: BDDOFHVZRMCKSF-OFDRTADWSA-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 melanocortin 4 receptor Starlite/ChEMBL No 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
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Brugia malayi acetylcholine receptor, alpha-type subunit unc-38 precursor 0.002 0.0031 0.0031
Loa Loa (eye worm) hypothetical protein 0.0038 0.0095 0.0095
Brugia malayi Kelch motif family protein 0.0024 0.0047 0.0047
Toxoplasma gondii dipeptidyl peptidase iv (dpp iv) n-terminal region domain-containing protein 0.0034 0.008 0.0845
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0019 0.0028 0.0291
Onchocerca volvulus 0.002 0.0031 0.0997
Loa Loa (eye worm) hypothetical protein 0.002 0.0031 0.0031
Schistosoma mansoni nAChR subunit 0.002 0.0031 0.0187
Loa Loa (eye worm) hypothetical protein 0.002 0.0031 0.0031
Loa Loa (eye worm) hypothetical protein 0.002 0.0031 0.0031
Echinococcus granulosus p2X purinoceptor 4 0.0025 0.0049 0.0506
Loa Loa (eye worm) excitatory GABA receptor EXP-1A 0.002 0.0031 0.0031
Echinococcus granulosus dipeptidyl aminopeptidaseprotein 0.0101 0.0309 0.3186
Echinococcus granulosus nAChR subunit 0.002 0.0031 0.0318
Loa Loa (eye worm) hypothetical protein 0.0043 0.011 0.011
Echinococcus granulosus glycine receptor subunit alpha 1 0.002 0.0031 0.0318
Schistosoma mansoni P2X receptor subunit 0.0025 0.0049 0.0298
Echinococcus granulosus sodium and chloride dependent glycine 0.0041 0.0103 0.1064
Echinococcus multilocularis nicotinic acetylcholine receptor a11 subunit 0.0056 0.0157 0.162
Loa Loa (eye worm) hypothetical protein 0.2935 1 1
Mycobacterium tuberculosis Probable polypeptide deformylase Def (PDF) (formylmethionine deformylase) 0.0127 0.04 1
Onchocerca volvulus Matrix metalloproteinase homolog 0.0094 0.0287 0.9292
Onchocerca volvulus Dipeptidyl peptidase family member 1 homolog 0.0101 0.0309 1
Schistosoma mansoni P2X receptor subunit 0.0025 0.0049 0.0298
Loa Loa (eye worm) ACC-1 protein 0.002 0.0031 0.0031
Loa Loa (eye worm) matrix metalloproteinase 0.0043 0.011 0.011
Echinococcus granulosus dnaJ subfamily B 0.0294 0.097 1
Loa Loa (eye worm) matrixin family protein 0.0094 0.0287 0.0287
Echinococcus granulosus nicotinic acetylcholine receptor alpha subunit 0.0056 0.0157 0.162
Echinococcus granulosus matrix metallopeptidase 7 M10 family 0.0135 0.0427 0.4403
Echinococcus granulosus p2X purinoceptor 4 0.0025 0.0049 0.0506
Schistosoma mansoni nAChR subunit 0.002 0.0031 0.0187
Schistosoma mansoni lamin 0.0039 0.0097 0.059
Brugia malayi follicle stimulating hormone receptor 0.0175 0.0562 0.0562
Loa Loa (eye worm) hypothetical protein 0.002 0.0031 0.0031
Brugia malayi Hypothetical 112.3 kDa protein K02A2.3 in chromosome II 0.0031 0.0071 0.0071
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.002 0.0031 0.0031
Loa Loa (eye worm) hypothetical protein 0.0018 0.0026 0.0026
Echinococcus multilocularis GA binding protein alpha chain 0.0052 0.0142 0.1465
Schistosoma mansoni intracisternal A-particle retropepsin (A02 family) 0.0492 0.1645 1
Loa Loa (eye worm) hypothetical protein 0.002 0.0031 0.0031
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0175 0.0562 0.0562
Loa Loa (eye worm) NNMT/PNMT/TEMT family protein 0.2935 1 1
Echinococcus granulosus glycine receptor subunit alpha 1 0.002 0.0031 0.0318
Onchocerca volvulus Matrilysin homolog 0.0094 0.0287 0.9292
Schistosoma mansoni intermediate filament proteins 0.0039 0.0097 0.059
Schistosoma mansoni nAChR subunit 0.002 0.0031 0.0187
Loa Loa (eye worm) hypothetical protein 0.002 0.0031 0.0031
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.002 0.0031 0.0187
Echinococcus multilocularis sodium and chloride dependent glycine 0.0041 0.0103 0.1064
Schistosoma mansoni subfamily S9B unassigned peptidase (S09 family) 0.0101 0.0309 0.1878
Echinococcus granulosus cpg binding protein 0.0022 0.0039 0.0399
Loa Loa (eye worm) hypothetical protein 0.002 0.0031 0.0031
Loa Loa (eye worm) hypothetical protein 0.0027 0.0056 0.0056
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.002 0.0031 0.0031
Schistosoma mansoni nAChR subunit (ShAR1-beta-like) 0.0056 0.0157 0.0955
Plasmodium falciparum peptide deformylase 0.0127 0.04 1
Loa Loa (eye worm) matrixin family protein 0.0084 0.025 0.025
Trypanosoma cruzi Peptide deformylase 2, putative 0.0049 0.013 1
Echinococcus multilocularis nicotinic acetylcholine receptor subunit alpha 8 0.0056 0.0157 0.162
Trichomonas vaginalis conserved hypothetical protein 0.0025 0.005 0.5
Loa Loa (eye worm) hypothetical protein 0.0056 0.0157 0.0157
Echinococcus multilocularis transcription factor btf3 0.0025 0.005 0.0521
Brugia malayi Cation transporter family protein 0.002 0.0031 0.0031
Wolbachia endosymbiont of Brugia malayi peptide deformylase 0.0127 0.04 0.5
Echinococcus granulosus GA binding protein alpha chain 0.0052 0.0142 0.1465
Echinococcus multilocularis nicotinic acetylcholine receptor alpha subunit 0.0056 0.0157 0.162
Brugia malayi Matrix metalloprotease, N-terminal domain containing protein 0.0052 0.0141 0.0141
Schistosoma mansoni gabp alpha 0.0052 0.0142 0.0864
Trypanosoma cruzi dipeptidyl-peptidase 8-like serine peptidase 0.0034 0.008 0.3698
Loa Loa (eye worm) hypothetical protein 0.0031 0.0071 0.0071
Echinococcus granulosus glycine receptor subunit alpha 1 0.002 0.0031 0.0318
Loa Loa (eye worm) LGC-31 protein 0.002 0.0031 0.0031
Schistosoma mansoni hypothetical protein 0.0294 0.097 0.5894
Loa Loa (eye worm) hypothetical protein 0.002 0.0031 0.0031
Onchocerca volvulus 0.0056 0.0157 0.5086
Trypanosoma brucei Peptide deformylase 2 0.0049 0.013 1
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0019 0.0028 0.0291
Loa Loa (eye worm) amino acid permease 0.0031 0.0071 0.0071
Echinococcus multilocularis musashi 0.0039 0.0097 0.1
Loa Loa (eye worm) nicotinic acetylcholine receptor non-alpha subunit 0.002 0.0031 0.0031
Echinococcus multilocularis dipeptidyl aminopeptidaseprotein 0.0101 0.0309 0.3186
Onchocerca volvulus 0.0021 0.0035 0.1121
Onchocerca volvulus Putative nachr subunit 0.0056 0.0157 0.5086
Loa Loa (eye worm) hypothetical protein 0.002 0.0031 0.0031
Loa Loa (eye worm) hypothetical protein 0.002 0.0031 0.0031
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.002 0.0031 0.0031
Echinococcus multilocularis dnaJ subfamily B 0.0294 0.097 1
Treponema pallidum polypeptide deformylase (def) 0.0127 0.04 0.5
Brugia malayi gamma-aminobutyric-acid receptor beta subunit precursor 0.002 0.0031 0.0031
Echinococcus granulosus sodium and chloride dependent glycine 0.0041 0.0103 0.1064
Brugia malayi hypothetical protein 0.0026 0.0053 0.0053
Onchocerca volvulus Matrilysin homolog 0.0043 0.011 0.355
Echinococcus granulosus lamin dm0 0.0039 0.0097 0.1
Brugia malayi Matrixin family protein 0.0084 0.025 0.025
Loa Loa (eye worm) hypothetical protein 0.0019 0.0028 0.0028
Echinococcus multilocularis solute carrier family 12 0.0031 0.0071 0.0729
Schistosoma mansoni nAChR subunit 0.002 0.0031 0.0187
Schistosoma mansoni nAChR subunit 0.002 0.0031 0.0187
Schistosoma mansoni solute carrier family 12 electroneutral k-cl cotransporter 0.0031 0.0071 0.043
Trypanosoma cruzi polypeptide deformylase-like protein, putative 0.0049 0.013 1
Schistosoma mansoni family A2 unassigned peptidase (A02 family) 0.0089 0.027 0.1639
Schistosoma mansoni sodium/chloride dependent transporter 0.0041 0.0103 0.0627
Echinococcus multilocularis acetylcholine receptor subunit beta 1 0.002 0.0031 0.0318
Echinococcus multilocularis matrix metallopeptidase 7 (M10 family) 0.0135 0.0427 0.4403
Loa Loa (eye worm) hypothetical protein 0.0031 0.0071 0.0071
Loa Loa (eye worm) hypothetical protein 0.0027 0.0056 0.0056
Loa Loa (eye worm) Sodium:neurotransmitter symporter family protein 0.0041 0.0103 0.0103
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.002 0.0031 0.0187
Echinococcus multilocularis sodium and chloride dependent glycine 0.0041 0.0103 0.1064
Schistosoma mansoni matrix metallopeptidase-7 (M10 family) 0.0043 0.011 0.0667
Trypanosoma brucei Dipeptidyl-peptidase 8-like, putative 0.0034 0.008 0.3698
Onchocerca volvulus 0.002 0.0031 0.0997
Loa Loa (eye worm) hypothetical protein 0.0027 0.0056 0.0056
Loa Loa (eye worm) hypothetical protein 0.0047 0.0126 0.0126
Loa Loa (eye worm) ligand-Gated ion Channel family member 0.002 0.0031 0.0031
Echinococcus granulosus nicotinic acetylcholine receptor subunit type 0.002 0.0031 0.0318
Brugia malayi CXXC zinc finger family protein 0.0021 0.0035 0.0035
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.002 0.0031 0.0031
Loa Loa (eye worm) hypothetical protein 0.0027 0.0056 0.0056
Echinococcus granulosus integrin beta 2 0.0112 0.0349 0.3595
Loa Loa (eye worm) hypothetical protein 0.0043 0.011 0.011
Onchocerca volvulus 0.0056 0.0157 0.5086
Echinococcus multilocularis glycine receptor subunit beta 0.002 0.0031 0.0318
Brugia malayi Matrixin family protein 0.0043 0.011 0.011
Loa Loa (eye worm) hypothetical protein 0.0027 0.0056 0.0056
Echinococcus multilocularis p2X purinoceptor 4 0.0025 0.0049 0.0506
Echinococcus multilocularis Dipeptidyl peptidase 9 0.0034 0.008 0.0825
Toxoplasma gondii histone lysine methyltransferase SET1 0.0039 0.0098 0.1355
Echinococcus multilocularis glycine receptor subunit alpha 1 0.002 0.0031 0.0318
Brugia malayi Hemopexin family protein 0.0041 0.0104 0.0104
Loa Loa (eye worm) acetylcholine receptor alpha subunit 0.002 0.0031 0.0031
Onchocerca volvulus 0.0043 0.011 0.355
Loa Loa (eye worm) CXXC zinc finger family protein 0.0021 0.0035 0.0035
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.002 0.0031 0.0031
Echinococcus multilocularis nAChR subunit 0.002 0.0031 0.0318
Schistosoma mansoni sodium/chloride dependent transporter 0.0041 0.0103 0.0627
Chlamydia trachomatis peptide deformylase 0.0127 0.04 0.5
Echinococcus multilocularis Cys loop ligand gated ion channel subunit 0.002 0.0031 0.0318
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.002 0.0031 0.0031
Onchocerca volvulus 0.0056 0.0157 0.5086
Schistosoma mansoni transcription factor btf3 0.0025 0.005 0.0307
Brugia malayi beta-NAC-like protein 0.0025 0.005 0.005
Mycobacterium ulcerans peptide deformylase 0.0127 0.04 1
Loa Loa (eye worm) hypothetical protein 0.002 0.0031 0.0031
Brugia malayi Fli-1 protein 0.0158 0.0505 0.0505
Loa Loa (eye worm) hypothetical protein 0.0031 0.0071 0.0071
Onchocerca volvulus 0.002 0.0031 0.0997
Loa Loa (eye worm) nicotinic acetylcholine receptor alpha subunit 0.0056 0.0157 0.0157
Loa Loa (eye worm) hypothetical protein 0.0031 0.0071 0.0071
Plasmodium vivax peptide deformylase, putative 0.0127 0.04 1
Echinococcus granulosus glycine receptor subunit beta 0.002 0.0031 0.0318
Loa Loa (eye worm) hypothetical protein 0.0041 0.0103 0.0103
Trichomonas vaginalis conserved hypothetical protein 0.0025 0.005 0.5
Brugia malayi Matrixin family protein 0.0043 0.011 0.011
Loa Loa (eye worm) hypothetical protein 0.0052 0.0141 0.0141
Onchocerca volvulus 0.0039 0.0097 0.314
Brugia malayi Ets-domain containing protein 0.0052 0.0142 0.0142
Echinococcus granulosus Cys loop ligand gated ion channel subunit 0.002 0.0031 0.0318
Brugia malayi excitatory GABA receptor EXP-1A 0.002 0.0031 0.0031
Echinococcus granulosus Dipeptidyl peptidase 9 0.0034 0.008 0.0825
Brugia malayi Intermediate filament tail domain containing protein 0.0039 0.0097 0.0097
Echinococcus multilocularis p2X purinoceptor 4 0.0025 0.0049 0.0506
Brugia malayi Cation transporter family protein 0.002 0.0031 0.0031
Trichomonas vaginalis conserved hypothetical protein 0.0025 0.005 0.5
Trypanosoma brucei serine peptidase, Clan SC, Family S9B 0.0034 0.008 0.3698
Loa Loa (eye worm) hypothetical protein 0.002 0.0031 0.0031
Brugia malayi acetylcholine receptor alpha subunit precursor, putative 0.002 0.0031 0.0031
Loa Loa (eye worm) hypothetical protein 0.0031 0.0071 0.0071
Brugia malayi prolyl oligopeptidase family protein 0.0034 0.008 0.008
Entamoeba histolytica hypothetical protein 0.0025 0.005 1
Loa Loa (eye worm) hypothetical protein 0.002 0.0031 0.0031
Trypanosoma cruzi polypeptide deformylase-like protein, putative 0.0049 0.013 1
Loa Loa (eye worm) hypothetical protein 0.0043 0.011 0.011
Loa Loa (eye worm) hypothetical protein 0.002 0.0031 0.0031
Loa Loa (eye worm) hypothetical protein 0.0045 0.0116 0.0116
Schistosoma mansoni nAChR subunit (ShAR1-beta2-like) 0.002 0.0031 0.0187
Schistosoma mansoni nAChR subunit (ShAR1-alpha-like) 0.0056 0.0157 0.0955
Brugia malayi Matrixin family protein 0.0043 0.011 0.011
Echinococcus multilocularis lamin dm0 0.0039 0.0097 0.1
Echinococcus granulosus acetylcholine receptor subunit beta 1 0.002 0.0031 0.0318
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0039 0.0097 0.0097
Toxoplasma gondii hypothetical protein 0.0127 0.04 1
Loa Loa (eye worm) ACC-1 protein 0.002 0.0031 0.0031
Echinococcus granulosus transcription factor btf3 0.0025 0.005 0.0521
Loa Loa (eye worm) hypothetical protein 0.2935 1 1
Loa Loa (eye worm) hypothetical protein 0.002 0.0031 0.0031
Mycobacterium leprae PROBABLE POLYPEPTIDE DEFORMYLASE DEF (PDF) (FORMYLMETHIONINE DEFORMYLASE) 0.0127 0.04 1
Trypanosoma cruzi Peptide deformylase 2, putative 0.0049 0.013 1
Loa Loa (eye worm) hypothetical protein 0.0056 0.0157 0.0157
Loa Loa (eye worm) hypothetical protein 0.002 0.0031 0.0031
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.002 0.0031 0.0031
Brugia malayi Ets-domain containing protein 0.0052 0.0142 0.0142
Brugia malayi cytoplasmic intermediate filament protein 0.0021 0.0035 0.0035
Echinococcus multilocularis p2X purinoceptor 4 0.0025 0.0049 0.0506
Loa Loa (eye worm) hypothetical protein 0.0031 0.0071 0.0071
Trypanosoma cruzi serine peptidase, Clan SC, Family S9B 0.0034 0.008 0.3698
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.002 0.0031 0.0031
Loa Loa (eye worm) hypothetical protein 0.0056 0.0157 0.0157
Brugia malayi acetylcholine receptor protein, alpha-like chain, putative 0.002 0.0031 0.0031
Loa Loa (eye worm) hypothetical protein 0.0026 0.0053 0.0053
Brugia malayi nicotinic acetylcholine receptor beta-1 chain precursor 0.002 0.0031 0.0031
Brugia malayi Matrixin family protein 0.0043 0.011 0.011
Echinococcus multilocularis glycine receptor subunit alpha 1 0.002 0.0031 0.0318
Loa Loa (eye worm) hypothetical protein 0.0027 0.0056 0.0056
Loa Loa (eye worm) hypothetical protein 0.0041 0.0103 0.0103
Onchocerca volvulus 0.0041 0.0104 0.3364
Echinococcus granulosus glycine receptor subunit beta 0.002 0.0031 0.0318
Schistosoma mansoni P2X receptor subunit 0.0025 0.0049 0.0298
Brugia malayi Amino acid permease family protein 0.0031 0.0071 0.0071
Leishmania major polypeptide deformylase-like protein, putative 0.0049 0.013 1
Echinococcus multilocularis glycine receptor subunit alpha 1 0.002 0.0031 0.0318
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0044 0.0114 0.0692
Schistosoma mansoni matrix metallopeptidase-9 (M10 family) 0.002 0.0031 0.0188
Echinococcus multilocularis lamin 0.0039 0.0097 0.1
Echinococcus multilocularis glycine receptor subunit beta 0.002 0.0031 0.0318
Echinococcus granulosus solute carrier family 12 0.0031 0.0071 0.0729
Loa Loa (eye worm) hypothetical protein 0.0018 0.0026 0.0026
Entamoeba histolytica transcription factor BTF3, putative 0.0025 0.005 1
Loa Loa (eye worm) hypothetical protein 0.0024 0.0047 0.0047
Brugia malayi hypothetical protein 0.0024 0.0047 0.0047
Loa Loa (eye worm) prolyl oligopeptidase 0.0101 0.0309 0.0309
Brugia malayi Hypothetical glycine receptor like protein T20B12.9 in chromosome III 0.002 0.0031 0.0031
Brugia malayi intermediate filament protein 0.0039 0.0097 0.0097
Brugia malayi nicotinic acetylcholine receptor alpha subunit, putative 0.0056 0.0157 0.0157
Onchocerca volvulus 0.0039 0.0097 0.314
Trypanosoma brucei Polypeptide deformylase 1 0.0049 0.013 1
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.002 0.0031 0.0187
Loa Loa (eye worm) kelch domain-containing protein family protein 0.0024 0.0047 0.0047
Brugia malayi Cation transporter family protein 0.0056 0.0157 0.0157
Loa Loa (eye worm) glutamate-gated chloride channel alpha3A subunit 0.002 0.0031 0.0031
Loa Loa (eye worm) D-ets-4 DNA binding domain-containing protein 0.0052 0.0142 0.0142
Loa Loa (eye worm) fli-1 protein 0.0158 0.0505 0.0505
Schistosoma mansoni cpg binding protein 0.0022 0.0039 0.0235
Echinococcus multilocularis nicotinic acetylcholine receptor beta 1 subunit 0.002 0.0031 0.0318
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0041 0.0103 0.0103
Loa Loa (eye worm) integrin beta-2 0.0154 0.0489 0.0489
Schistosoma mansoni hypothetical protein 0.0041 0.0104 0.0632
Echinococcus multilocularis integrin beta 2 0.0112 0.0349 0.3595
Brugia malayi prolyl oligopeptidase family protein 0.0101 0.0309 0.0309
Echinococcus granulosus intermediate filament protein 0.0039 0.0097 0.1
Echinococcus granulosus nicotinic acetylcholine receptor subunit alpha 8 0.0056 0.0157 0.162
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.002 0.0031 0.0031
Schistosoma mansoni cpg binding protein 0.0022 0.0039 0.0235
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0021 0.0035 0.0035
Schistosoma mansoni nAChR subunit 0.002 0.0031 0.0187
Echinococcus multilocularis neuronal acetylcholine receptor subunit alpha 4 0.002 0.0031 0.0318
Loa Loa (eye worm) hypothetical protein 0.0039 0.0097 0.0097
Echinococcus granulosus p2X purinoceptor 4 0.0025 0.0049 0.0506
Loa Loa (eye worm) hypothetical protein 0.0027 0.0056 0.0056
Leishmania major dipeptidyl-peptidase 8-like serine peptidase, putative,serine peptidase, Clan SC, Family S9B 0.0034 0.008 0.3698
Schistosoma mansoni integrin beta subunit 0.0088 0.0266 0.1618
Echinococcus granulosus lamin 0.0039 0.0097 0.1
Echinococcus granulosus nicotinic acetylcholine receptor beta 1 subunit 0.002 0.0031 0.0318
Loa Loa (eye worm) ICD-1 protein 0.0025 0.005 0.005
Schistosoma mansoni ets-related 0.0158 0.0505 0.3067
Loa Loa (eye worm) hypothetical protein 0.0031 0.0071 0.0071
Echinococcus granulosus neuronal acetylcholine receptor subunit alpha 4 0.002 0.0031 0.0318
Schistosoma mansoni cpg binding protein 0.0021 0.0035 0.0211
Schistosoma mansoni lamin 0.0039 0.0097 0.059
Echinococcus granulosus nicotinic acetylcholine receptor a11 subunit 0.0056 0.0157 0.162
Schistosoma mansoni P2X receptor subunit 0.0025 0.0049 0.0298
Schistosoma mansoni dipeptidyl-peptidase 9 (S09 family) 0.0034 0.008 0.0486
Brugia malayi Integrin beta pat-3 precursor 0.0154 0.0489 0.0489
Echinococcus multilocularis cpg binding protein 0.0022 0.0039 0.0399
Schistosoma mansoni nAChR subunit 0.002 0.0031 0.0187
Loa Loa (eye worm) intermediate filament protein 0.0039 0.0097 0.0097

Activities

Activity type Activity value Assay description Source Reference
Ki (binding) = 9 nM Competitive Inhibition Assay BINDINGDB. No reference
Ki (binding) = 9 nM Competitive Inhibition Assay Using [I125]-NDP-a-MSH BINDINGDB. No reference

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

No literature references available for this target.

If you have references for this compound, please enter them in a user comment (below) or Contact us.