Detailed information for compound 984239

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 494.662 | Formula: C31H42O5
  • H donors: 0 H acceptors: 4 LogP: 6.14 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(=O)/C=C/C(=O)/C(=C/C=C/C(=C/1\C(=O)C[C@@H]2[C@]1(C)CC[C@@H]1[C@]2(C)CC[C@@H](C1(C)C)OC(=O)C)/C)/C
  • InChi: 1S/C31H42O5/c1-19(23(34)13-12-21(3)32)10-9-11-20(2)28-24(35)18-26-30(7)17-15-27(36-22(4)33)29(5,6)25(30)14-16-31(26,28)8/h9-13,25-27H,14-18H2,1-8H3/b11-9+,13-12+,19-10+,28-20+/t25-,26-,27-,30-,31-/m0/s1
  • InChiKey: CDPPOXOHMOXLAH-SQBDJJPTSA-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
Plasmodium vivax protease, putative 0.0037 0.0467 0.3467
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0106 0.15 0.8837
Echinococcus multilocularis peptidase Clp (S14 family) 0.0051 0.0665 0.0665
Brugia malayi CAAX amino terminal protease family protein 0.0181 0.2612 0.7756
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0027 0.0307 0.1708
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.005 0.0654 0.2046
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0016 0.0151 0.0151
Loa Loa (eye worm) hypothetical protein 0.001 0.0057 0.017
Trichomonas vaginalis Clan U, family U48, CaaX prenyl peptidase 2-like 0.0181 0.2612 0.7759
Schistosoma mansoni hypothetical protein 0.0166 0.2387 0.2387
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.001 0.0057 0.0057
Trichomonas vaginalis set domain proteins, putative 0.0231 0.3364 1
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.001 0.0057 0.0057
Plasmodium vivax SET domain protein, putative 0.003 0.0353 0.2214
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0057 0.017
Brugia malayi ecdysteroid receptor 0.001 0.0057 0.017
Schistosoma mansoni coup transcription factor 0.001 0.0057 0.0057
Toxoplasma gondii CMGC kinase, MAPK family (ERK) MAPK-1 0.005 0.0654 0.5524
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.001 0.0057 0.017
Schistosoma mansoni thyroid hormone receptor 0.001 0.0057 0.0057
Leishmania major CAAX prenyl protease 2, putative,peptidase with unknown catalytic mechanism (family U48) 0.0181 0.2612 1
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0016 0.0151 0.0151
Mycobacterium ulcerans dihydrolipoamide dehydrogenase, LpdB 0.0016 0.0151 0.1421
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.001 0.0057 0.017
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0093 0.1299 0.1299
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.001 0.0057 0.0057
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.001 0.0057 0.0057
Mycobacterium ulcerans hypothetical protein 0.0037 0.0467 0.4395
Schistosoma mansoni retinoic acid receptor RXR 0.001 0.0057 0.0057
Trypanosoma brucei trypanothione reductase 0.0047 0.0607 0.1852
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.001 0.0057 0.0057
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.001 0.0057 0.017
Brugia malayi glutathione reductase 0.0047 0.0607 0.1802
Onchocerca volvulus 0.0028 0.0329 0.0979
Loa Loa (eye worm) hypothetical protein 0.001 0.0057 0.017
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0077 0.1062 1
Brugia malayi steroid hormone receptor 0.001 0.0057 0.017
Echinococcus multilocularis dnaJ subfamily B 0.04 0.589 0.589
Trichomonas vaginalis glutathione reductase, putative 0.0016 0.0151 0.0436
Schistosoma mansoni microtubule-associated protein tau 0.0675 1 1
Echinococcus granulosus survival motor neuron protein 1 0.0231 0.3367 0.3367
Brugia malayi Steroid receptor seven-up type 2 0.001 0.0057 0.017
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0016 0.0151 0.0449
Trypanosoma cruzi CAAX prenyl protease 2, putative 0.0181 0.2612 1
Loa Loa (eye worm) hypothetical protein 0.0231 0.3367 1
Echinococcus multilocularis thioredoxin glutathione reductase 0.0047 0.0607 0.0607
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0008 0.003 0.003
Brugia malayi F/Y-rich N-terminus family protein 0.001 0.0054 0.0159
Mycobacterium tuberculosis Probable integral membrane protein 0.0037 0.0467 0.207
Plasmodium falciparum thioredoxin reductase 0.0047 0.0607 0.4999
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0077 0.1062 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.001 0.0057 0.017
Trichomonas vaginalis CMGC family protein kinase 0.005 0.0654 0.1934
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0057 0.0057
Trichomonas vaginalis CMGC family protein kinase 0.005 0.0654 0.1934
Mycobacterium tuberculosis Probable dehydrogenase 0.0106 0.15 0.8837
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0134 0.1918 0.1918
Schistosoma mansoni hypothetical protein 0.04 0.589 0.589
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0106 0.15 0.8705
Schistosoma mansoni family U48 unassigned peptidase (U48 family) 0.0181 0.2612 0.2612
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0134 0.1918 0.1918
Trypanosoma cruzi mitogen activated protein kinase 4, putative 0.005 0.0654 0.2046
Echinococcus granulosus dnaJ subfamily B 0.04 0.589 0.589
Trypanosoma brucei mitogen activated protein kinase 4, putative 0.005 0.0654 0.2046
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0134 0.1918 0.5697
Brugia malayi alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase 0.0012 0.0087 0.0258
Toxoplasma gondii hypothetical protein 0.0027 0.0307 0.1708
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0077 0.1062 0.5514
Schistosoma mansoni serine/threonine protein kinase 0.005 0.0654 0.0654
Echinococcus granulosus geminin 0.0166 0.2387 0.2387
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0047 0.0615 0.1826
Brugia malayi photoreceptor-specific nuclear receptor 0.001 0.0057 0.017
Loa Loa (eye worm) hypothetical protein 0.001 0.0057 0.017
Brugia malayi Nuclear hormone receptor-like 1 0.001 0.0057 0.017
Brugia malayi Thioredoxin reductase 0.0047 0.0607 0.1802
Schistosoma mansoni RAR-like nuclear receptor 0.001 0.0057 0.0057
Onchocerca volvulus 0.001 0.0057 0.017
Toxoplasma gondii histone lysine methyltransferase SET1 0.0054 0.0721 0.6254
Giardia lamblia Kinase, CMGC MAPK 0.005 0.0654 0.2046
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0118 0.1677 1
Mycobacterium tuberculosis Probable conserved integral membrane protein 0.0037 0.0467 0.207
Echinococcus granulosus mixed lineage leukemia protein mll 0.0008 0.003 0.003
Schistosoma mansoni Tr4/Tr2 (homologue) 0.001 0.0057 0.0057
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.001 0.0057 0.017
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0027 0.0307 0.1708
Toxoplasma gondii hypothetical protein 0.0037 0.0467 0.3467
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0057 0.017
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0057 0.017
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.0051 0.0665 0.3369
Loa Loa (eye worm) hypothetical protein 0.0077 0.1062 0.3155
Schistosoma mansoni retinoid-x-receptor (RXR) 0.001 0.0057 0.0057
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0134 0.1918 0.1918
Toxoplasma gondii CAAX amino terminal protease family protein 0.0037 0.0467 0.3467
Onchocerca volvulus 0.0047 0.0615 0.1827
Brugia malayi Nuclear hormone receptor family member nhr-41 0.001 0.0057 0.017
Schistosoma mansoni cpg binding protein 0.003 0.0353 0.0353
Loa Loa (eye worm) hypothetical protein 0.001 0.0057 0.017
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0028 0.0328 0.0328
Brugia malayi hypothetical protein 0.0231 0.3367 1
Brugia malayi Nuclear hormone receptor family member nhr-14 0.001 0.0057 0.017
Mycobacterium tuberculosis Probable conserved integral membrane protein 0.0037 0.0467 0.207
Chlamydia trachomatis hypothetical protein 0.0037 0.0467 0.3467
Onchocerca volvulus 0.0087 0.1208 0.3591
Schistosoma mansoni nuclear hormone receptor 0.001 0.0057 0.0057
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0077 0.1062 0.1062
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0077 0.1062 1
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0077 0.1062 0.1062
Mycobacterium ulcerans integral membrane protein 0.0037 0.0467 0.4395
Loa Loa (eye worm) hypothetical protein 0.0181 0.2612 0.7756
Loa Loa (eye worm) CXXC zinc finger family protein 0.0028 0.0329 0.0978
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.001 0.0055 0.0055
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein 0.0012 0.0087 0.0258
Mycobacterium tuberculosis Probable reductase 0.0106 0.15 0.8837
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0106 0.15 0.8837
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0077 0.1062 1
Echinococcus granulosus CAAX prenyl protease 2 0.0181 0.2612 0.2612
Brugia malayi Probable ClpP-like protease 0.0077 0.1062 0.3155
Echinococcus granulosus ecdysone induced protein 78C 0.001 0.0057 0.0057
Brugia malayi Nuclear hormone receptor family member nhr-1 0.001 0.0057 0.017
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0118 0.1677 1
Entamoeba histolytica CAAX prenyl protease family 0.0181 0.2612 1
Trypanosoma brucei CAAX amino terminal protease, putative 0.0181 0.2612 1
Echinococcus multilocularis cpg binding protein 0.003 0.0353 0.0353
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0077 0.1062 1
Echinococcus granulosus retinoic acid receptor rxr beta a 0.001 0.0057 0.0057
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0134 0.1918 0.1918
Echinococcus multilocularis microtubule associated protein 2 0.0675 1 1
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0027 0.0307 0.1708
Schistosoma mansoni peptidase Clp (S14 family) 0.0077 0.1062 0.1062
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0353 0.0353
Mycobacterium tuberculosis Probable oxidoreductase 0.0118 0.1677 1
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.001 0.0057 0.0057
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0077 0.1062 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0353 0.0353
Echinococcus multilocularis mitogen activated protein kinase 3 0.005 0.0654 0.0654
Mycobacterium ulcerans flavoprotein disulfide reductase 0.0016 0.0151 0.1421
Loa Loa (eye worm) thioredoxin reductase 0.0047 0.0607 0.1802
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.0051 0.0665 0.2616
Brugia malayi Nuclear hormone receptor family member nhr-40 0.001 0.0057 0.017
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0353 0.0353
Brugia malayi nuclear hormone receptor 0.001 0.0057 0.017
Loa Loa (eye worm) hypothetical protein 0.0093 0.1299 0.3858
Schistosoma mansoni steroid hormone receptor ad4bp 0.001 0.0057 0.0057
Echinococcus multilocularis survival motor neuron protein 1 0.0231 0.3367 0.3367
Trypanosoma brucei protein kinase, putative 0.005 0.0654 0.2046
Loa Loa (eye worm) hypothetical protein 0.001 0.0057 0.017
Echinococcus multilocularis FTZ F1 alpha 0.001 0.0057 0.0057
Leishmania major mitogen activated protein kinase, putative,map kinase, putative 0.005 0.0654 0.2046
Loa Loa (eye worm) hypothetical protein 0.001 0.0057 0.017
Trypanosoma cruzi peptidase with unknown catalytic mechanism (family U48) 0.0181 0.2612 1
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.001 0.0057 0.0057
Echinococcus granulosus FTZ F1 alpha 0.001 0.0057 0.0057
Onchocerca volvulus Protein ultraspiracle homolog 0.001 0.0057 0.017
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0106 0.15 0.8837
Onchocerca volvulus 0.0093 0.1299 0.3861
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0077 0.1062 1
Echinococcus granulosus thioredoxin glutathione reductase 0.0047 0.0607 0.0607
Brugia malayi Pre-SET motif family protein 0.003 0.0353 0.1048
Trichomonas vaginalis CMGC family protein kinase 0.005 0.0654 0.1934
Brugia malayi Nuclear hormone receptor family member nhr-49 0.001 0.0057 0.017
Loa Loa (eye worm) hypothetical protein 0.001 0.0057 0.017
Echinococcus granulosus cpg binding protein 0.003 0.0353 0.0353
Loa Loa (eye worm) histone methyltransferase 0.001 0.0055 0.0164
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0134 0.1918 0.5697
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0077 0.1062 1
Brugia malayi Nuclear hormone receptor family member nhr-3 0.001 0.0057 0.017
Echinococcus granulosus histone lysine methyltransferase setb 0.003 0.0353 0.0353
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0093 0.1299 0.1299
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0057 0.017
Echinococcus multilocularis geminin 0.0166 0.2387 0.2387
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0057 0.0057
Schistosoma mansoni survival motor neuron protein 0.0047 0.0615 0.0615
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.001 0.0057 0.0057
Echinococcus multilocularis CAAX prenyl protease 2 0.0181 0.2612 0.2612
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.003 0.0353 0.0353
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0106 0.15 0.8837
Plasmodium vivax thioredoxin reductase, putative 0.0047 0.0607 0.4999
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0134 0.1918 0.1918
Mycobacterium ulcerans dihydrolipoamide dehydrogenase 0.0016 0.0151 0.1421
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0057 0.0057
Echinococcus multilocularis mitogen activated protein kinase 0.005 0.0654 0.0654
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0057 0.017
Plasmodium falciparum glutathione reductase 0.0047 0.0607 0.4999
Onchocerca volvulus 0.003 0.0353 0.1049
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0008 0.003 0.003
Echinococcus granulosus peptidase Clp S14 family 0.0051 0.0665 0.0665
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.001 0.0057 0.017
Treponema pallidum hypothetical protein 0.0037 0.0467 0.3467
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.003 0.0353 0.2214
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0077 0.1062 1
Brugia malayi nuclear receptor NHR-88 0.001 0.0057 0.017
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.001 0.0057 0.017
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0057 0.0057
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.001 0.0057 0.0057
Schistosoma mansoni cpg binding protein 0.003 0.0353 0.0353
Leishmania major trypanothione reductase 0.0047 0.0607 0.1852
Brugia malayi Trypsin family protein 0.0093 0.1299 0.3858
Loa Loa (eye worm) hypothetical protein 0.003 0.0353 0.1048
Onchocerca volvulus Bile acid receptor homolog 0.001 0.0057 0.017
Echinococcus multilocularis thyroid hormone receptor alpha 0.001 0.0057 0.0057
Brugia malayi Nuclear hormone receptor family member nhr-31 0.001 0.0057 0.017
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0061 0.0816 0.0816
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0008 0.003 0.003
Leishmania major mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440 0.005 0.0654 0.2046
Plasmodium falciparum protease, putative 0.0037 0.0467 0.3467
Schistosoma mansoni family U48 unassigned peptidase (U48 family) 0.0181 0.2612 0.2612
Giardia lamblia Hypothetical protein 0.0181 0.2612 1
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.005 0.0654 0.2046
Loa Loa (eye worm) hypothetical protein 0.001 0.0057 0.017
Trypanosoma cruzi trypanothione reductase, putative 0.0047 0.0607 0.1852
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0134 0.1918 0.1918
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0077 0.1062 1
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0203 0.2946 0.875
Trypanosoma cruzi mitogen activated protein kinase 2, putative 0.005 0.0654 0.2046
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0008 0.003 0.003
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.005 0.0654 0.1944
Echinococcus granulosus mitogen activated protein kinase 3 0.005 0.0654 0.0654
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.001 0.0057 0.017
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.001 0.0055 0.0055
Trichomonas vaginalis CMGC family protein kinase 0.005 0.0654 0.1934
Plasmodium vivax glutathione reductase, putative 0.0047 0.0607 0.4999
Brugia malayi MAP kinase sur-1 0.005 0.0654 0.1944
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0118 0.1677 1
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0016 0.0151 0.0151
Echinococcus multilocularis ecdysone induced protein 78C 0.001 0.0057 0.0057
Brugia malayi Pre-SET motif family protein 0.0203 0.2946 0.875
Toxoplasma gondii hypothetical protein 0.0037 0.0467 0.3467
Schistosoma mansoni thyroid hormone receptor 0.001 0.0057 0.0057
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0057 0.017
Schistosoma mansoni cpg binding protein 0.0028 0.0329 0.0329
Schistosoma mansoni hypothetical protein 0.0047 0.0615 0.0615
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.001 0.0057 0.0057
Loa Loa (eye worm) glutathione reductase 0.0047 0.0607 0.1802
Onchocerca volvulus 0.0231 0.3364 1
Mycobacterium tuberculosis Conserved hypothetical protein 0.0037 0.0467 0.207
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.001 0.0057 0.0057
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.001 0.0057 0.0057
Toxoplasma gondii thioredoxin reductase 0.0047 0.0607 0.4999
Schistosoma mansoni hypothetical protein 0.0166 0.2387 0.2387
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.003 0.0353 0.0353
Trichomonas vaginalis mercuric reductase, putative 0.0016 0.0151 0.0436
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.0051 0.0665 0.3369
Loa Loa (eye worm) hypothetical protein 0.0093 0.1299 0.3858
Loa Loa (eye worm) steroid hormone receptor 0.001 0.0057 0.017
Echinococcus granulosus mitogen activated protein kinase 0.005 0.0654 0.0654
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.003 0.0353 0.0353
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0134 0.1918 0.1918
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0047 0.0607 0.2985
Mycobacterium ulcerans hypothetical protein 0.0037 0.0467 0.4395
Brugia malayi CXXC zinc finger family protein 0.0028 0.0329 0.0978

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) > 5 ug ml-1 Cytotoxicity against human HL60 cells after 48 hrs by MTT assay ChEMBL. 15620246
IC50 (functional) > 5 ug ml-1 Cytotoxicity against human BGC823 cells after 48 hrs by MTT assay ChEMBL. 15620246
IC50 (functional) > 5 ug ml-1 Cytotoxicity against human Bel7402 cells after 48 hrs by MTT assay ChEMBL. 15620246
IC50 (functional) > 5 ug ml-1 Cytotoxicity against human HeLa cells after 48 hrs by MTT assay ChEMBL. 15620246

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens ChEMBL23 15620246

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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