Detailed information for compound 1252606

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 575.679 | Formula: C30H33N5O5S
  • H donors: 2 H acceptors: 5 LogP: 2.73 Rotable bonds: 11
    Rule of 5 violations (Lipinski): 2
  • SMILES: CCN(C(=O)c1ccc2c(c1)NC(=O)/C/2=C(/c1ccccc1)\Nc1ccc(cc1)N(S(=O)(=O)C)CC(=O)N(C)C)C
  • InChi: 1S/C30H33N5O5S/c1-6-34(4)30(38)21-12-17-24-25(18-21)32-29(37)27(24)28(20-10-8-7-9-11-20)31-22-13-15-23(16-14-22)35(41(5,39)40)19-26(36)33(2)3/h7-18,31H,6,19H2,1-5H3,(H,32,37)/b28-27-
  • InChiKey: DLXGDQAWZVGPQU-DQSJHHFOSA-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 activin A receptor, type IB Starlite/ChEMBL References
Homo sapiens platelet-derived growth factor receptor, alpha polypeptide Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus multilocularis TGF beta receptor type 1 Get druggable targets OG5_129709 All targets in OG5_129709
Schistosoma mansoni protein kinase Get druggable targets OG5_129709 All targets in OG5_129709
Schistosoma japonicum ko:K04674 transforming growth factor, beta receptor I, putative Get druggable targets OG5_129709 All targets in OG5_129709
Echinococcus granulosus TGF beta receptor type 1 Get druggable targets OG5_129709 All targets in OG5_129709
Echinococcus granulosus TGF-beta receptor type-1 Get druggable targets OG5_129709 All targets in OG5_129709
Loa Loa (eye worm) TKL/STKR/TYPE1 protein kinase Get druggable targets OG5_129709 All targets in OG5_129709
Brugia malayi bone morphogenetic protein type 1 receptor Get druggable targets OG5_129709 All targets in OG5_129709
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
Schistosoma mansoni GTP-binding protein (q) alpha-11 subunit gna11 0.0012 0.0043 0.0075
Loa Loa (eye worm) hypothetical protein 0.0164 0.2041 0.203
Schistosoma mansoni hypothetical protein 0.0033 0.0318 0.0561
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0092 0.1096 0.1931
Echinococcus multilocularis guanine nucleotide binding protein subunit 0.0012 0.0043 0.0075
Echinococcus granulosus gtp binding protein I alpha 1subunit 0.0012 0.0043 0.0075
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.0096 0.1146 0.2019
Brugia malayi Guanine nucleotide-binding protein alpha-6 subunit, putative 0.0012 0.0043 0.0028
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.001 0.0015 0.0026
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0092 0.1096 0.1931
Mycobacterium leprae probable zinc metalloprotease 0.019 0.2384 1
Loa Loa (eye worm) hypothetical protein 0.003 0.0277 0.0263
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.0046 0.0494 0.087
Schistosoma mansoni Tr4/Tr2 (homologue) 0.001 0.0015 0.0026
Loa Loa (eye worm) hypothetical protein 0.0085 0.0997 0.0984
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0058 0.0644 0.063
Trypanosoma brucei hypothetical protein, conserved 0.011 0.1335 1
Mycobacterium ulcerans esterase/lipase LipP 0.011 0.1335 0.4395
Loa Loa (eye worm) hypothetical protein 0.011 0.1335 0.1323
Loa Loa (eye worm) beta-lactamase 0.011 0.1335 0.1323
Schistosoma mansoni cpg binding protein 0.0033 0.0315 0.0554
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.011 0.1335 0.1323
Loa Loa (eye worm) hypothetical protein 0.0058 0.0644 0.063
Brugia malayi Guanine nucleotide-binding protein alpha-3 subunit, putative 0.0012 0.0043 0.0028
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.001 0.0015 0.0026
Echinococcus granulosus guanine nucleotide binding protein subunit 0.0012 0.0043 0.0075
Echinococcus granulosus leukotriene A 4 hydrolase 0.0253 0.3211 0.5656
Brugia malayi follicle stimulating hormone receptor 0.0224 0.2832 0.2821
Echinococcus multilocularis TGF beta receptor type 1 0.0191 0.24 0.4227
Schistosoma mansoni family M13 non-peptidase homologue (M13 family) 0.0096 0.1146 0.2019
Loa Loa (eye worm) hypothetical protein 0.0094 0.1123 0.111
Brugia malayi protein C17H12.11 0.0074 0.0851 0.0837
Schistosoma mansoni neprilysin 0.005 0.0537 0.0946
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.001 0.0015 0.0026
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.028 0.3556 0.6265
Leishmania major aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1 0.0092 0.1096 0.7091
Brugia malayi hypothetical protein 0.0205 0.2583 0.2572
Schistosoma mansoni coup transcription factor 0.001 0.0015 0.0026
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.028 0.3556 0.6265
Trichomonas vaginalis penicillin-binding protein, putative 0.011 0.1335 0.447
Mycobacterium tuberculosis Probable zinc metalloprotease Zmp1 0.019 0.2384 0.1342
Loa Loa (eye worm) TKL/STKR/TYPE1 protein kinase 0.0193 0.2419 0.2407
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.001 0.0015 0.0026
Echinococcus multilocularis FTZ F1 alpha 0.001 0.0015 0.0026
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.0046 0.0494 0.087
Schistosoma mansoni trimeric G-protein alpha o subunit 0.0012 0.0043 0.0075
Brugia malayi beta-lactamase 0.011 0.1335 0.1323
Schistosoma mansoni GTP-binding protein (I) alpha-2 subunit gnai2 0.0012 0.0043 0.0075
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.028 0.3556 0.6265
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0092 0.1096 0.1931
Brugia malayi Protein kinase domain containing protein 0.0074 0.0854 0.0841
Plasmodium vivax M1-family alanyl aminopeptidase, putative 0.0048 0.0513 0.2228
Loa Loa (eye worm) hypothetical protein 0.0048 0.0513 0.0499
Loa Loa (eye worm) histone methyltransferase 0.0011 0.0025 0.001
Brugia malayi hypothetical protein 0.0092 0.1096 0.1083
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0048 0.0513 0.0903
Schistosoma mansoni cpg binding protein 0.0031 0.0292 0.0514
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0011 0.0025 0.0044
Trypanosoma cruzi metallo-peptidase, clan MA(E), family M1, putative 0.0048 0.0513 0.0516
Schistosoma mansoni leukotriene A4 hydrolase (M01 family) 0.0253 0.3211 0.5656
Loa Loa (eye worm) hypothetical protein 0.0044 0.0468 0.0454
Leishmania major hypothetical protein, conserved 0.011 0.1335 1
Loa Loa (eye worm) GTP-binding regulatory protein alpha chain 0.0012 0.0043 0.0028
Loa Loa (eye worm) hypothetical protein 0.0074 0.0851 0.0837
Schistosoma mansoni protein kinase 0.0191 0.24 0.4227
Loa Loa (eye worm) hypothetical protein 0.0144 0.1776 0.1763
Schistosoma mansoni aminopeptidase A (M01 family) 0.0048 0.0513 0.0903
Loa Loa (eye worm) hypothetical protein 0.0144 0.1776 0.1763
Echinococcus multilocularis guanine nucleotide binding protein (G protein) 0.0012 0.0043 0.0075
Schistosoma mansoni integrin alpha-ps 0.0069 0.0789 0.139
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0048 0.0513 0.1626
Mycobacterium ulcerans aminopeptidase N PepN 0.0092 0.1096 0.3117
Loa Loa (eye worm) hypothetical protein 0.0141 0.1732 0.172
Echinococcus multilocularis activin receptor type 0.0088 0.1043 0.1837
Echinococcus granulosus TGF-beta receptor type-1 0.0191 0.24 0.4227
Schistosoma mansoni protein kinase 0.0088 0.1039 0.1831
Echinococcus granulosus TGF beta receptor type 1 0.0191 0.24 0.4227
Trypanosoma cruzi hypothetical protein, conserved 0.011 0.1335 1
Echinococcus multilocularis Peptidase M1, membrane alanine aminopeptidase, N terminal 0.0092 0.1096 0.1931
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0092 0.1096 0.1931
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0067 0.0762 0.1342
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.028 0.3556 0.3547
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0277 0.0488
Trypanosoma cruzi aminopeptidase, putative 0.0092 0.1096 0.7241
Echinococcus granulosus ecdysone induced protein 78C 0.001 0.0015 0.0026
Onchocerca volvulus 0.0232 0.2935 0.902
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.0096 0.1146 0.2019
Loa Loa (eye worm) hypothetical protein 0.0144 0.1776 0.1763
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.001 0.0015 0.0026
Loa Loa (eye worm) guanine nucleotide-binding protein alpha-12 subunit 0.0012 0.0043 0.0028
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.0046 0.0494 0.087
Loa Loa (eye worm) hypothetical protein 0.0144 0.1776 0.1763
Echinococcus granulosus guanine nucleotide binding protein G protein 0.0012 0.0043 0.0075
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0028 0.0254 0.0447
Schistosoma mansoni hypothetical protein 0.005 0.0537 0.0946
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0092 0.1096 0.1931
Loa Loa (eye worm) hypothetical protein 0.011 0.1335 0.1323
Echinococcus granulosus endothelin converting enzyme 1 0.019 0.2384 0.42
Echinococcus multilocularis gtp binding protein (I) alpha 1subunit 0.0012 0.0043 0.0075
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0015 0.0026
Trichomonas vaginalis D-aminoacylase, putative 0.011 0.1335 0.447
Schistosoma mansoni family M13 non-peptidase homologue (M13 family) 0.0046 0.0494 0.087
Echinococcus granulosus cpg binding protein 0.0033 0.0315 0.0554
Schistosoma mansoni hypothetical protein 0.005 0.0537 0.0946
Loa Loa (eye worm) hypothetical protein 0.0044 0.0468 0.0454
Echinococcus multilocularis guanine nucleotide binding protein subunit 0.0012 0.0043 0.0075
Loa Loa (eye worm) hypothetical protein 0.0116 0.141 0.1398
Loa Loa (eye worm) peptidase family M1 containing protein 0.0212 0.2669 0.2658
Echinococcus multilocularis dnaJ subfamily B 0.0441 0.5677 1
Trypanosoma cruzi Aminopeptidase M1, putative 0.0092 0.1096 0.7241
Trypanosoma cruzi metallo-peptidase, clan MA(E), family M1, putative 0.0092 0.1096 0.7241
Brugia malayi Peptidase family M13 containing protein 0.019 0.2384 0.2373
Echinococcus granulosus histone acetyltransferase MYST2 0.0058 0.0644 0.1134
Mycobacterium ulcerans beta-lactamase 0.011 0.1335 0.4395
Echinococcus multilocularis expressed protein 0.0012 0.0043 0.0075
Brugia malayi bone morphogenetic protein type 1 receptor 0.0193 0.2419 0.2407
Loa Loa (eye worm) peptidase family M13 containing protein 0.0141 0.1732 0.172
Brugia malayi Pre-SET motif family protein 0.003 0.0277 0.0263
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0051 0.0551 0.0971
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.011 0.1335 0.4395
Echinococcus multilocularis serine:threonine protein kinase receptor R3 0.0086 0.1021 0.1798
Schistosoma mansoni GTP-binding protein alpha subunit gna 0.0012 0.0043 0.0075
Onchocerca volvulus 0.0051 0.0551 0.1658
Trypanosoma cruzi hypothetical protein, conserved 0.011 0.1335 1
Echinococcus granulosus activin receptor type 0.0088 0.1043 0.1837
Brugia malayi G-protein alpha subunit 0.0012 0.0043 0.0028
Schistosoma mansoni hypothetical protein 0.005 0.0537 0.0946
Schistosoma mansoni GTP-binding protein alpha subunit 0.0012 0.0043 0.0075
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1 0.0092 0.1096 0.7091
Loa Loa (eye worm) peptidase family M13 containing protein 0.0141 0.1732 0.172
Echinococcus multilocularis beta LACTamase domain containing family member 0.011 0.1335 0.2352
Loa Loa (eye worm) angiotensin-converting enzyme family protein 0.077 1 1
Mycobacterium ulcerans lipase LipD 0.011 0.1335 0.4395
Brugia malayi guanine nucleotide-binding protein G(o), alpha subunit, putative 0.0012 0.0043 0.0028
Toxoplasma gondii histone lysine methyltransferase SET1 0.006 0.0669 0.1862
Echinococcus multilocularis endothelin converting enzyme 1 0.019 0.2384 0.42
Loa Loa (eye worm) hypothetical protein 0.0012 0.0043 0.0028
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.019 0.2384 0.42
Schistosoma mansoni integrin alpha 0.0154 0.1901 0.3349
Loa Loa (eye worm) hypothetical protein 0.0012 0.0043 0.0028
Schistosoma mansoni GTP-binding protein (I) alpha subunit gnai 0.0012 0.0043 0.0075
Echinococcus multilocularis thyroid hormone receptor alpha 0.001 0.0015 0.0026
Brugia malayi GTP-binding regulatory protein alpha chain - starfish, putative 0.0012 0.0043 0.0028
Echinococcus multilocularis ecdysone induced protein 78C 0.001 0.0015 0.0026
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0092 0.1096 0.3642
Loa Loa (eye worm) hypothetical protein 0.0144 0.1776 0.1763
Echinococcus granulosus integrin alpha ps 0.0069 0.0789 0.139
Brugia malayi hypothetical protein 0.0048 0.0513 0.0499
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0092 0.1096 0.1931
Brugia malayi guanine nucleotide-binding protein G-o protein alpha subunit 0.0012 0.0043 0.0028
Trypanosoma brucei Aminopeptidase M1, putative 0.0092 0.1096 0.7091
Brugia malayi Peptidase family M1 containing protein 0.0048 0.0513 0.0499
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.028 0.3556 0.3547
Echinococcus multilocularis integrin alpha ps 0.0033 0.0318 0.0561
Brugia malayi CXXC zinc finger family protein 0.0031 0.0292 0.0277
Trichomonas vaginalis D-aminoacylase, putative 0.011 0.1335 0.447
Loa Loa (eye worm) hypothetical protein 0.0012 0.0043 0.0028
Brugia malayi F/Y-rich N-terminus family protein 0.0011 0.0023 0.0009
Echinococcus granulosus integrin alpha ps 0.0033 0.0318 0.0561
Loa Loa (eye worm) hypothetical protein 0.0033 0.0318 0.0304
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.011 0.1335 0.2352
Loa Loa (eye worm) aminopeptidase N 0.0092 0.1096 0.1083
Loa Loa (eye worm) MBCTL1 0.0058 0.0644 0.063
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.011 0.1335 0.1323
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0092 0.1096 0.3642
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0015 0.0026
Echinococcus granulosus retinoic acid receptor rxr beta a 0.001 0.0015 0.0026
Trichomonas vaginalis esterase, putative 0.011 0.1335 0.447
Loa Loa (eye worm) G protein alpha subunit 3 0.0012 0.0043 0.0028
Echinococcus granulosus dnaJ subfamily B 0.0441 0.5677 1
Schistosoma mansoni neprilysin-2 (M13 family) 0.0096 0.1146 0.2019
Onchocerca volvulus 0.011 0.1335 0.4079
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.001 0.0015 0.0026
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.001 0.0015 0.0026
Loa Loa (eye worm) hypothetical protein 0.011 0.1335 0.1323
Loa Loa (eye worm) hypothetical protein 0.0048 0.0513 0.0499
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0092 0.1096 0.1931
Onchocerca volvulus 0.0048 0.0513 0.1539
Schistosoma mansoni hypothetical protein 0.005 0.0537 0.0946
Schistosoma mansoni family M1 non-peptidase homologue (M01 family) 0.0044 0.0468 0.0825
Mycobacterium ulcerans hypothetical protein 0.011 0.1335 0.4395
Onchocerca volvulus 0.011 0.1335 0.4079
Echinococcus granulosus SAM and MBT domain containing protein 0.0051 0.0551 0.0971
Trypanosoma brucei metallo-peptidase, Clan MA(E) Family M1 0.0092 0.1096 0.7091
Onchocerca volvulus 0.0012 0.0043 0.0086
Onchocerca volvulus 0.011 0.1335 0.4079
Schistosoma mansoni endothelin-converting enzyme-related 0.0046 0.0494 0.087
Toxoplasma gondii aminopeptidase N protein 0.0048 0.0513 0.1119
Trichomonas vaginalis penicillin-binding protein, putative 0.011 0.1335 0.447
Schistosoma mansoni retinoid-x-receptor (RXR) 0.001 0.0015 0.0026
Trichomonas vaginalis D-aminoacylase, putative 0.011 0.1335 0.447
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.011 0.1335 0.2352
Schistosoma mansoni thyroid hormone receptor 0.001 0.0015 0.0026
Loa Loa (eye worm) TKL/STKR/TYPE1 protein kinase 0.0074 0.0854 0.0841
Brugia malayi hypothetical protein 0.0012 0.0043 0.0028
Loa Loa (eye worm) TKL/STKR/TYPE2 protein kinase 0.0074 0.0854 0.0841
Onchocerca volvulus 0.0012 0.0043 0.0086
Echinococcus multilocularis integrin alpha ps 0.0069 0.0789 0.139
Loa Loa (eye worm) heterotrimeric G protein alpha subunit 0.0012 0.0043 0.0028
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0015 0.0026
Schistosoma mansoni endothelin-converting enzyme-like 1 (damage-induced neuronal endopeptidase) 0.0046 0.0494 0.087
Schistosoma mansoni integrin alpha-ps 0.0036 0.0356 0.0626
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0277 0.0488
Brugia malayi mbt repeat family protein 0.0051 0.0551 0.0537
Loa Loa (eye worm) hypothetical protein 0.0141 0.1732 0.172
Brugia malayi Guanine nucleotide-binding protein alpha-3 subunit, putative 0.0012 0.0043 0.0028
Entamoeba histolytica aminopeptidase, putative 0.0092 0.1096 1
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0058 0.0644 0.1134
Onchocerca volvulus 0.003 0.0277 0.081
Echinococcus multilocularis guanine nucleotide binding protein (G protein) 0.0012 0.0043 0.0075
Toxoplasma gondii peptidase family M13 protein 0.019 0.2384 1
Echinococcus granulosus histone lysine methyltransferase setb 0.003 0.0277 0.0488
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.003 0.0277 0.0488
Brugia malayi Integrin alpha pat-2 precursor 0.0154 0.1901 0.189
Brugia malayi Peptidase family M1 containing protein 0.0256 0.3252 0.3243
Mycobacterium ulcerans zinc metalloprotease 0.019 0.2384 1
Echinococcus multilocularis polycomb protein SCMH1 0.0051 0.0551 0.0971
Schistosoma mansoni GTP-binding protein (I) alpha-2 subunit gnai2 0.0012 0.0043 0.0075
Echinococcus multilocularis cpg binding protein 0.0033 0.0315 0.0554
Echinococcus granulosus beta LACTamase domain containing family member 0.011 0.1335 0.2352
Schistosoma mansoni aminopeptidase PILS (M01 family) 0.0092 0.1096 0.1931
Trypanosoma cruzi puromycin-sensitive aminopeptidase-like protein, putative 0.0048 0.0513 0.0516
Schistosoma mansoni cpg binding protein 0.0033 0.0315 0.0554
Loa Loa (eye worm) hypothetical protein 0.0209 0.2624 0.2614
Schistosoma mansoni sex comb on midleg homolog 0.0051 0.0551 0.0971
Loa Loa (eye worm) leukotriene A4 hydrolase 0.0253 0.3211 0.3201
Schistosoma mansoni hypothetical protein 0.005 0.0537 0.0946
Onchocerca volvulus 0.0094 0.1123 0.3424
Loa Loa (eye worm) hypothetical protein 0.011 0.1335 0.1323
Schistosoma mansoni nuclear hormone receptor 0.001 0.0015 0.0026
Loa Loa (eye worm) hypothetical protein 0.019 0.2384 0.2373
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0044 0.0468 0.0825
Schistosoma mansoni sex comb on midleg homolog 0.0051 0.0551 0.0971
Schistosoma mansoni myelin transcription factor 1 myt1 0.0058 0.0644 0.1134
Echinococcus granulosus endonuclease exonuclease phosphatase 0.02 0.2511 0.4423
Loa Loa (eye worm) TATA binding protein associated factor 0.0048 0.0513 0.0499
Trypanosoma cruzi aminopeptidase, putative 0.0048 0.0513 0.0516
Loa Loa (eye worm) mbt repeat family protein 0.0051 0.0551 0.0537
Brugia malayi Hypothetical zinc metalloproteinase T16A9.4 0.019 0.2384 0.2373
Brugia malayi TATA binding protein associated factor 0.0048 0.0513 0.0499
Brugia malayi guanine nucleotide-binding protein alpha-3 subunit, putative 0.0012 0.0043 0.0028
Echinococcus granulosus guanine nucleotide binding protein subunit 0.0012 0.0043 0.0075
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.003 0.0277 0.0488
Echinococcus granulosus aminopeptidase N 0.0256 0.3252 0.5729
Echinococcus granulosus polycomb protein SCMH1 0.0051 0.0551 0.0971
Echinococcus multilocularis integrin alpha ps 0.0069 0.0789 0.139
Loa Loa (eye worm) hypothetical protein 0.0144 0.1776 0.1763
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.02 0.2511 0.4423
Echinococcus multilocularis SAM and MBT domain containing protein 0.0051 0.0551 0.0971
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.001 0.0015 0.0026
Echinococcus multilocularis leukotriene A 4 hydrolase 0.0253 0.3211 0.5656
Toxoplasma gondii aminopeptidase N, putative 0.0048 0.0513 0.1119
Loa Loa (eye worm) guanine nucleotide-binding protein alpha-6 subunit 0.0012 0.0043 0.0028
Echinococcus multilocularis histone acetyltransferase MYST2 0.0058 0.0644 0.1134
Loa Loa (eye worm) hypothetical protein 0.011 0.1335 0.1323
Schistosoma mansoni Tata binding protein associated factor (M01 family) 0.0048 0.0513 0.0903
Echinococcus granulosus guanine nucleotide binding protein G protein 0.0012 0.0043 0.0075
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0224 0.2832 0.2821
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.028 0.3556 0.6265
Loa Loa (eye worm) integrin alpha pat-2 0.0237 0.2993 0.2983
Schistosoma mansoni hypothetical protein 0.005 0.0537 0.0946
Loa Loa (eye worm) hypothetical protein 0.0036 0.0356 0.0341
Plasmodium falciparum M1-family alanyl aminopeptidase, putative 0.0048 0.0513 0.5
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.001 0.0015 0.0026
Loa Loa (eye worm) hypothetical protein 0.0051 0.0551 0.0537
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0015 0.0026
Loa Loa (eye worm) hypothetical protein 0.019 0.2384 0.2373
Trypanosoma cruzi puromycin-sensitive aminopeptidase-like protein, putative 0.0048 0.0513 0.0516
Loa Loa (eye worm) CXXC zinc finger family protein 0.0031 0.0292 0.0277
Plasmodium vivax hypothetical protein, conserved 0.011 0.1335 1
Loa Loa (eye worm) hypothetical protein 0.011 0.1335 0.1323
Brugia malayi guanine nucleotide-binding protein alpha-7 subunit, putative 0.0012 0.0043 0.0028
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0204 0.2566 0.2555
Plasmodium falciparum M1-family alanyl aminopeptidase 0.0048 0.0513 0.5
Schistosoma mansoni cytosol alanyl aminopeptidase (M01 family) 0.0092 0.1096 0.1931
Trypanosoma brucei Aminopeptidase M1, putative 0.0092 0.1096 0.7091
Brugia malayi Peptidase family M1 containing protein 0.0092 0.1096 0.1083
Schistosoma mansoni GTP-binding protein (q) alpha-11 subunit gna11 0.0012 0.0043 0.0075
Brugia malayi Guanine nucleotide-binding protein alpha-12 subunit, putative 0.0012 0.0043 0.0028
Plasmodium vivax M1-family alanyl aminopeptidase, putative 0.0048 0.0513 0.2228
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0092 0.1096 0.1931
Schistosoma mansoni GTP-binding protein (I) alpha-2 subunit gnai2 0.0012 0.0043 0.0075
Echinococcus multilocularis aminopeptidase N 0.0256 0.3252 0.5729
Schistosoma mansoni GTP-binding protein alpha subunit gna 0.0012 0.0043 0.0075
Loa Loa (eye worm) hypothetical protein 0.0121 0.1468 0.1456
Onchocerca volvulus 0.0031 0.0292 0.0855
Loa Loa (eye worm) hypothetical protein 0.0141 0.1732 0.172
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0277 0.0488
Echinococcus granulosus expressed protein 0.0012 0.0043 0.0075
Schistosoma mansoni GTP-binding protein (I) alpha-1subunit gnai1 0.0012 0.0043 0.0075
Brugia malayi mbt repeat family protein 0.0051 0.0551 0.0537
Schistosoma mansoni Nep2 peptidase (M13 family) 0.0096 0.1146 0.2019
Schistosoma mansoni hypothetical protein 0.0308 0.3936 0.6934
Schistosoma mansoni GTP-binding protein (I) alpha-1subunit gnai1 0.0012 0.0043 0.0075
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.001 0.0015 0.0026
Schistosoma mansoni hypothetical protein 0.0441 0.5677 1
Echinococcus granulosus FTZ F1 alpha 0.001 0.0015 0.0026
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.001 0.0015 0.0026
Schistosoma mansoni thyroid hormone receptor 0.001 0.0015 0.0026
Schistosoma mansoni retinoic acid receptor RXR 0.001 0.0015 0.0026
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0048 0.0513 0.0903
Loa Loa (eye worm) hypothetical protein 0.0141 0.1732 0.172
Toxoplasma gondii ABC1 family protein 0.011 0.1335 0.5023
Onchocerca volvulus 0.0012 0.0043 0.0086
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.003 0.0277 0.0488
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0058 0.0644 0.1134
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.028 0.3556 0.6265
Loa Loa (eye worm) hypothetical protein 0.019 0.2384 0.2373
Brugia malayi beta-lactamase family protein 0.011 0.1335 0.1323
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.001 0.0015 0.0026
Trichomonas vaginalis set domain proteins, putative 0.0232 0.2935 1
Schistosoma mansoni GTP-binding protein alpha subunit 0.0012 0.0043 0.0075
Brugia malayi Integrin alpha cytoplasmic region family protein 0.0116 0.141 0.1398
Brugia malayi peptidase family M13 containing protein 0.0046 0.0494 0.048
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.005 0.0537 0.0946
Echinococcus multilocularis integrin alpha 3 0.0118 0.1431 0.252
Onchocerca volvulus 0.0092 0.1096 0.334
Brugia malayi beta-lactamase family protein 0.011 0.1335 0.1323
Onchocerca volvulus 0.0256 0.3252 1
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0092 0.1096 0.1931
Loa Loa (eye worm) hypothetical protein 0.0012 0.0043 0.0028
Loa Loa (eye worm) hypothetical protein 0.0048 0.0513 0.0499
Echinococcus granulosus integrin alpha 3 0.0118 0.1431 0.252
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0051 0.0551 0.1658
Trypanosoma cruzi metallo-peptidase, Clan MA(E) Family M1 0.0048 0.0513 0.0516
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.028 0.3556 0.6265
Loa Loa (eye worm) hypothetical protein 0.0012 0.0043 0.0028
Toxoplasma gondii aminopeptidase n, putative 0.0048 0.0513 0.1119
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.028 0.3556 0.6265
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0011 0.0025 0.0044
Brugia malayi hypothetical protein 0.0074 0.0851 0.0837
Schistosoma mansoni RAR-like nuclear receptor 0.001 0.0015 0.0026
Brugia malayi Pre-SET motif family protein 0.0204 0.2566 0.2555
Schistosoma mansoni steroid hormone receptor ad4bp 0.001 0.0015 0.0026
Loa Loa (eye worm) zinc metallopeptidase 4 0.0046 0.0494 0.048
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0706 0.9152 1

Activities

Activity type Activity value Assay description Source Reference
EC50 (binding) > 3000 nM Inhibition of TGFbeta receptor in human HaCaT cells assessed as Smad phosphorylation by ELISA ChEMBL. 20919678
IC50 (binding) = 86 nM Inhibition of TGFbeta receptor ChEMBL. 20919678
IC50 (binding) = 410 nM Inhibition of PDGFRalpha ChEMBL. 20919678

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.

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