Detailed information for compound 37043

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 679.652 | Formula: C31H42N3O12P
  • H donors: 6 H acceptors: 9 LogP: -1.69 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 3
  • SMILES: O=C1C=CC2(C(=C1)[C@H](C)CC1[C@H]2C(O)CC2(C1CC[C@@]2(O)C(=O)COP(=O)(OCC1OC(C(C1O)O)n1ccc(nc1=O)N)O)C)C
  • InChi: 1S/C31H42N3O12P/c1-15-10-17-18-5-8-31(41,30(18,3)12-20(36)24(17)29(2)7-4-16(35)11-19(15)29)22(37)14-45-47(42,43)44-13-21-25(38)26(39)27(46-21)34-9-6-23(32)33-28(34)40/h4,6-7,9,11,15,17-18,20-21,24-27,36,38-39,41H,5,8,10,12-14H2,1-3H3,(H,42,43)(H2,32,33,40)/t15-,17?,18?,20?,21?,24+,25?,26?,27?,29?,30?,31-/m0/s1
  • InChiKey: KAYOGQYWDZFHLB-GLXFMALPSA-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
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0024 0.0076 0.0046
Schistosoma mansoni thyroid hormone receptor 0.0173 0.1754 1
Loa Loa (eye worm) hypothetical protein 0.0024 0.0076 0.0046
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0024 0.0076 0.0434
Schistosoma mansoni ATP synthase alpha subunit mitochondrial 0.0039 0.0246 0.1405
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0024 0.0076 0.0046
Trypanosoma cruzi DNA polymerase kappa, putative 0.0049 0.0354 0.4715
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0024 0.0076 0.0046
Brugia malayi hypothetical protein 0.0383 0.4118 1
Mycobacterium leprae PROBABLE ATP SYNTHASE BETA CHAIN ATPD 0.0039 0.0246 1
Echinococcus multilocularis survival motor neuron protein 1 0.0264 0.2779 0.2738
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0024 0.0076 0.0046
Loa Loa (eye worm) hypothetical protein 0.0264 0.2779 0.6703
Echinococcus granulosus FTZ F1 alpha 0.0024 0.0076 0.0046
Loa Loa (eye worm) hypothetical protein 0.0024 0.0076 0.0046
Trypanosoma brucei DNA polymerase kappa, putative 0.0049 0.0354 0.4953
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0024 0.0076 0.0046
Trypanosoma cruzi DNA polymerase kappa, putative 0.0049 0.0354 0.4715
Loa Loa (eye worm) hypothetical protein 0.0024 0.0076 0.0046
Echinococcus multilocularis Glycoside hydrolase, family 27 0.0121 0.1172 0.1121
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0078 0.0686 1
Mycobacterium tuberculosis holo-[acyl-carrier protein] synthase AcpS (holo-ACP synthase) (CoA:APO-[ACP]pantetheinephosphotransferase) (CoA:APO-[acyl-carrie 0.0028 0.0118 0.3226
Brugia malayi hypothetical protein 0.0264 0.2779 0.6703
Treponema pallidum V-type ATP synthase subunit B 0.0039 0.025 1
Trypanosoma brucei Vacuolar proton pump subunit B, putative 0.0039 0.025 0.3369
Trypanosoma brucei DNA polymerase kappa, putative 0.0049 0.0354 0.4953
Plasmodium falciparum V-type proton ATPase subunit B 0.0039 0.025 1
Brugia malayi Melibiase family protein 0.0081 0.0717 0.1624
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0024 0.0076 0.0046
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0022 0.0057 0.0451
Mycobacterium ulcerans DNA polymerase IV 0.0049 0.0354 1
Brugia malayi ecdysteroid receptor 0.0024 0.0076 0.0046
Schistosoma mansoni ap endonuclease 0.0022 0.0057 0.0327
Entamoeba histolytica V-type ATPase, B subunit, putative 0.0039 0.025 0.3056
Wolbachia endosymbiont of Brugia malayi ATP synthase F0F1 subunit alpha 0.0039 0.0246 1
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0054 0.0413 0.0876
Toxoplasma gondii melibiase subfamily protein 0.0121 0.1172 1
Loa Loa (eye worm) steroid hormone receptor 0.0024 0.0076 0.0046
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0024 0.0076 0.0046
Loa Loa (eye worm) tyrosyl-DNA phosphodiesterase 0.0078 0.0686 0.1549
Trypanosoma brucei unspecified product 0.0041 0.0266 0.3619
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0024 0.0076 0.0046
Trypanosoma brucei ATP synthase F1, alpha subunit 0.0032 0.0169 0.2138
Brugia malayi polk-prov protein 0.0037 0.0221 0.0403
Trypanosoma brucei DNA polymerase kappa, putative 0.0049 0.0354 0.4953
Echinococcus granulosus vacuolar ATP synthase subunit b 0.0039 0.025 0.0473
Toxoplasma gondii 4'-phosphopantetheinyl transferase superfamily protein 0.0028 0.0118 0.1011
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0024 0.0076 0.0019
Chlamydia trachomatis V-type ATP synthase subunit B 0.0039 0.025 1
Loa Loa (eye worm) hypothetical protein 0.0024 0.0076 0.0046
Loa Loa (eye worm) hypothetical protein 0.0037 0.0221 0.0403
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0149 0.1484 0.3514
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0024 0.0076 0.0046
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0024 0.0076 0.0046
Echinococcus granulosus transcription factor Dp 1 0.0045 0.0316 0.0637
Leishmania major ATPase alpha subunit 0.0032 0.0169 0.1767
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0024 0.0076 0.0046
Echinococcus granulosus ATP synthase subunit alpha mitochondrial 0.0039 0.0246 0.0465
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0121 0.1172 0.6681
Schistosoma mansoni ap endonuclease 0.0022 0.0057 0.0327
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0024 0.0076 0.0046
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0024 0.0076 0.0046
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0024 0.0076 0.0046
Brugia malayi ATP synthase alpha chain, mitochondrial precursor, putative 0.0039 0.0246 0.0465
Schistosoma mansoni hypothetical protein 0.0149 0.1484 0.8464
Treponema pallidum 4'-phosphopantetheinyl transferase 0.0028 0.0118 0.3173
Schistosoma mansoni steroid hormone receptor ad4bp 0.0024 0.0076 0.0434
Echinococcus granulosus ecdysone induced protein 78C 0.0024 0.0076 0.0046
Schistosoma mansoni coup transcription factor 0.0024 0.0076 0.0434
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0024 0.0076 0.0019
Echinococcus granulosus dna polymerase kappa 0.0049 0.0354 0.073
Trypanosoma brucei DNA polymerase IV, putative 0.0049 0.0354 0.4953
Plasmodium vivax ATP synthase alpha chain, putative 0.0039 0.0246 0.9833
Trichomonas vaginalis ATP synthase, putative 0.0039 0.025 0.2915
Trichomonas vaginalis ATP synthase alpha subunit mitochondrial, putative 0.0039 0.025 0.2915
Trichomonas vaginalis DNA polymerase eta, putative 0.0049 0.0354 0.4497
Trypanosoma brucei DNA polymerase kappa, putative 0.0049 0.0354 0.4953
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0024 0.0076 0.0434
Mycobacterium tuberculosis Probable ATP synthase alpha chain AtpA 0.0039 0.0246 1
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0024 0.0076 0.0046
Schistosoma mansoni thyroid hormone receptor 0.0173 0.1754 1
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0024 0.0076 0.0019
Brugia malayi Tyrosyl-DNA phosphodiesterase family protein 0.0078 0.0686 0.1549
Schistosoma mansoni tyrosyl-DNA phosphodiesterase 0.0078 0.0686 0.3914
Echinococcus multilocularis FTZ F1 alpha 0.0024 0.0076 0.0019
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0024 0.0076 0.0046
Echinococcus multilocularis L aminoadipate semialdehyde 0.0099 0.0915 0.0862
Echinococcus multilocularis Alpha N acetylgalactosaminidase 0.0121 0.1172 0.1121
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0025 0.0088 0.1596
Trypanosoma brucei DNA polymerase kappa, putative 0.0049 0.0354 0.4953
Entamoeba histolytica tyrosyl-DNA phosphodiesterase, putative 0.0078 0.0686 1
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0024 0.0076 0.0019
Trypanosoma brucei ATP synthase F1, alpha subunit 0.0032 0.0169 0.2138
Mycobacterium ulcerans DNA polymerase IV 0.0049 0.0354 1
Echinococcus multilocularis thyroid hormone receptor alpha 0.0173 0.1754 0.1706
Schistosoma mansoni ATP synthase subunit beta vacuolar 0.0039 0.025 0.1424
Trypanosoma brucei DNA polymerase kappa, putative 0.0025 0.0088 0.0909
Plasmodium vivax holo-[acyl-carrier-protein] synthase, putative 0.0028 0.0118 0.3173
Brugia malayi aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase 0.0099 0.0915 0.2111
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0121 0.1172 0.6681
Trypanosoma brucei DNA polymerase kappa, putative 0.0037 0.0221 0.2934
Brugia malayi nuclear receptor NHR-88 0.0024 0.0076 0.0046
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0024 0.0076 0.0046
Onchocerca volvulus 0.0054 0.0413 0.4019
Echinococcus multilocularis ecdysone induced protein 78C 0.0024 0.0076 0.0019
Echinococcus granulosus L aminoadipate semialdehyde 0.0099 0.0915 0.2111
Echinococcus multilocularis ATP synthase subunit alpha, mitochondrial 0.0039 0.0246 0.019
Echinococcus granulosus tyrosyl DNA phosphodiesterase 1 0.0078 0.0686 0.1549
Brugia malayi photoreceptor-specific nuclear receptor 0.0024 0.0076 0.0046
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0024 0.0076 0.0046
Mycobacterium ulcerans phosphopantetheinyl transferase, PptII 0.0028 0.0118 0.2056
Loa Loa (eye worm) hypothetical protein 0.0024 0.0076 0.0046
Echinococcus granulosus survival motor neuron protein 1 0.0264 0.2779 0.6703
Brugia malayi Steroid receptor seven-up type 2 0.0024 0.0076 0.0046
Echinococcus multilocularis ATPase, H+ transporting, lysosomal accessory 0.0383 0.4118 0.4084
Schistosoma mansoni aminoadipate-semialdehyde dehydrogenase 0.0099 0.0915 0.5216
Loa Loa (eye worm) hypothetical protein 0.0383 0.4118 1
Trypanosoma cruzi V-type proton ATPase subunit B, putative 0.0039 0.025 0.3056
Trypanosoma cruzi Vacuolar proton pump subunit B, putative 0.0039 0.025 0.3056
Echinococcus granulosus ATPase H transporting lysosomal accessory 0.0383 0.4118 1
Loa Loa (eye worm) hypothetical protein 0.0024 0.0076 0.0046
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0024 0.0076 0.0046
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0024 0.0076 0.0046
Trypanosoma brucei hypothetical protein, conserved 0.0028 0.0118 0.1377
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0024 0.0076 0.0434
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0121 0.1172 0.6681
Echinococcus multilocularis tyrosyl DNA phosphodiesterase 1 0.0078 0.0686 0.0633
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0024 0.0076 0.0434
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0024 0.0076 0.0019
Onchocerca volvulus 0.0099 0.0915 1
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0024 0.0076 0.0434
Leishmania major vacuolar ATP synthase subunit b, putative 0.0039 0.025 0.3056
Giardia lamblia Vacuolar ATP synthase subunit B 0.0039 0.025 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0049 0.0354 0.4953
Leishmania major ATPase alpha subunit 0.0032 0.0169 0.1767
Wolbachia endosymbiont of Brugia malayi 4'-phosphopantetheinyl transferase 0.0028 0.0118 0.3226
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0121 0.1172 0.6681
Loa Loa (eye worm) vacuolar ATP synthase subunit B 0.0039 0.025 0.0473
Brugia malayi nuclear hormone receptor 0.0024 0.0076 0.0046
Brugia malayi Nuclear hormone receptor-like 1 0.0024 0.0076 0.0046
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0024 0.0076 0.0434
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0024 0.0076 0.0046
Trypanosoma cruzi DNA polymerase kappa, putative 0.0049 0.0354 0.4715
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0024 0.0076 0.0046
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0024 0.0076 0.0046
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0025 0.0088 0.048
Echinococcus multilocularis vacuolar ATP synthase subunit b 0.0039 0.025 0.0193
Schistosoma mansoni hypothetical protein 0.0054 0.0413 0.2356
Mycobacterium ulcerans F0F1 ATP synthase subunit alpha 0.0039 0.0246 0.6373
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0078 0.0686 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0049 0.0354 0.4953
Leishmania major tyrosyl-DNA phosphodiesterase 1 0.0078 0.0686 1
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0024 0.0076 0.0046
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0024 0.0076 0.0019
Trypanosoma brucei DNA polymerase IV, putative 0.0041 0.0266 0.3619
Schistosoma mansoni survival motor neuron protein 0.0054 0.0413 0.2356
Onchocerca volvulus ATP synthase subunit alpha, mitochondrial homolog 0.0039 0.0246 0.2031
Plasmodium falciparum ATP synthase F1, alpha subunit 0.0039 0.0246 0.9833
Trypanosoma brucei DNA polymerase kappa, putative 0.0049 0.0354 0.4953
Leishmania major DNA polymerase kappa, putative 0.0025 0.0088 0.048
Plasmodium vivax vacuolar ATP synthase subunit b, putative 0.0039 0.025 1
Brugia malayi vacuolar ATP synthase subunit B 0.0039 0.025 0.0473
Leishmania major phosphopantetheinyl transferase-like protein 0.0028 0.0118 0.097
Mycobacterium ulcerans 4'-phosphopantetheinyl transferase 0.0028 0.0118 0.2056
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0081 0.0717 0.4088
Toxoplasma gondii vacuolar ATP synthase subunit b, putative 0.0039 0.025 0.2131
Treponema pallidum V-type ATP synthase subunit B 0.0039 0.025 1
Trypanosoma brucei DNA polymerase IV, putative 0.0049 0.0354 0.4953
Toxoplasma gondii 4'-phosphopantetheinyl transferase domain-containing protein 0.0028 0.0118 0.1011
Loa Loa (eye worm) hypothetical protein 0.0099 0.0915 0.2111
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0081 0.0717 0.4088
Schistosoma mansoni RAR-like nuclear receptor 0.0024 0.0076 0.0434
Loa Loa (eye worm) hypothetical protein 0.0024 0.0076 0.0046
Giardia lamblia DINP protein human, muc B family 0.0025 0.0088 0.157
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0024 0.0076 0.0046
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0024 0.0076 0.0046
Trypanosoma cruzi DNA polymerase kappa, putative 0.0049 0.0354 0.4715
Plasmodium falciparum holo-[acyl-carrier-protein] synthase, putative 0.0028 0.0118 0.3173
Trypanosoma brucei tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0078 0.0686 1
Trichomonas vaginalis alpha-galactosidase/alpha-N-acetylgalactosaminidase, putative 0.0081 0.0717 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0049 0.0354 0.4953
Trypanosoma brucei DNA polymerase kappa, putative 0.0037 0.0221 0.2934
Echinococcus multilocularis transcription factor Dp 1 0.0045 0.0316 0.026
Echinococcus multilocularis dna polymerase kappa 0.0049 0.0354 0.0298
Loa Loa (eye worm) hypothetical protein 0.0081 0.0717 0.1624
Mycobacterium leprae PROBABLE ATP SYNTHASE ALPHA CHAIN ATPA 0.0039 0.0246 1
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0149 0.1484 0.1435
Mycobacterium tuberculosis Probable ATP synthase beta chain AtpD 0.0039 0.0246 1
Toxoplasma gondii exonuclease III APE 0.0022 0.0057 0.049
Schistosoma mansoni retinoic acid receptor RXR 0.0024 0.0076 0.0434
Schistosoma mansoni nuclear hormone receptor 0.0024 0.0076 0.0434
Loa Loa (eye worm) hypothetical protein 0.0024 0.0076 0.0046
Brugia malayi steroid hormone receptor 0.0024 0.0076 0.0046
Entamoeba histolytica hypothetical protein 0.0028 0.0118 0.097
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0049 0.0354 0.4497
Echinococcus granulosus Alpha N acetylgalactosaminidase 0.0121 0.1172 0.2744
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0024 0.0076 0.0046

Activities

Activity type Activity value Assay description Source Reference
ED 50 (functional) = 0.45 uM In Vitro evaluation of the compound for the antiproliferative activity by observing the growth inhibition of L1210 lymphoid leukemia cells in culture at 72 hour ChEMBL. 7452687
ILS (functional) = 84 % Antitumor activity in the mice with intraperitoneal implanted L1210 lymphoid leukemia at the dose 25 mg/kg/day x 5 was determined as percentage increase in the life span as compared with control tumor bearers ChEMBL. 7452687
ILS (functional) = 90 % Antitumor activity in the mice with intraperitoneal implanted L1210 lymphoid leukemia at the dose 75 mg/kg/day x 5 was determined as percentage increase in the life span as compared with control tumor bearers ChEMBL. 7452687
ILS (functional) = 156 % Antitumor activity in the mice with intraperitoneal implanted L1210 lymphoid leukemia at the dose 50 mg/kg/day x 5 was determined as percentage increase in the life span as compared with control tumor bearers ChEMBL. 7452687
Survival time (functional) = 13 day Antitumor activity in the mice with intraperitoneal implanted L1210 lymphoid leukemia at the dose 25 mg/kg/day x 5 was determined as Survival time in days; Range is 13- >45 days ChEMBL. 7452687
Survival time (functional) = 14 day Antitumor activity in the mice with intraperitoneal implanted L1210 lymphoid leukemia at the dose 50 mg/kg/day x 5 was determined as Survival time in days; Range is 14-24 days ChEMBL. 7452687
Survival time (functional) = 15 day Antitumor activity in the mice with intraperitoneal implanted L1210 lymphoid leukemia at the dose 75 mg/kg/day x 5 was determined as Survival time in days; Range is 15-37 days ChEMBL. 7452687
Survivors (functional) = 0 Antitumor activity in the mice with intraperitoneal implanted L1210 lymphoid leukemia at the dose 50 mg/kg/day x 5 was determined and number of animals survived on 30 th day were reported; 0/8 ChEMBL. 7452687
Survivors (functional) = 1 Antitumor activity in the mice with intraperitoneal implanted L1210 lymphoid leukemia at the dose 25 mg/kg/day x 5 was determined and number of animals survived on 30 th day were reported; 1/8 ChEMBL. 7452687
Survivors (functional) = 1 Antitumor activity in the mice with intraperitoneal implanted L1210 lymphoid leukemia at the dose 75 mg/kg/day x 5 was determined and number of animals survived on 30 th day were reported; 1/8 ChEMBL. 7452687
T/C (functional) = 17.5 Antitumor activity in the mice with intraperitoneal implanted L1210 lymphoid leukemia at the dose of 25 mg/kg/day x 5 was determined as mean survival of treated group compared to untreated; 17.5/9.5 ChEMBL. 7452687
T/C (functional) = 18 Antitumor activity in the mice with intraperitoneal implanted L1210 lymphoid leukemia at the dose of 75 mg/kg/day x 5 was determined as mean survival of treated group compared to untreated; 18/9.5 ChEMBL. 7452687
T/C (functional) = 20.5 Antitumor activity in the mice with intraperitoneal implanted L1210 lymphoid leukemia at the dose of 50 mg/kg/day x 5 was determined as mean survival of treated group compared to untreated; 20.5/8 ChEMBL. 7452687
Weight change (functional) = -1.08 g mouse-1 Antitumor activity in mice with intraperitoneal implanted L1210 lymphoid leukemia at the dose 50 mg/kg/day x 5 was determined as weight change (g/mouse) on 8th day ChEMBL. 7452687
Weight change (functional) = -1.07 g mouse-1 Antitumor activity in mice with intraperitoneal implanted L1210 lymphoid leukemia at the dose 75 mg/kg/day x 5 was determined as weight change (g/mouse) on 8th day ChEMBL. 7452687
Weight change (functional) = 2 g mouse-1 Antitumor activity in mice with intraperitoneal implanted L1210 lymphoid leukemia at the dose 25 mg/kg/day x 5 was determined as weight change (g/mouse) on 8th day ChEMBL. 7452687

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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