Detailed information for compound 1635659

Basic information

Technical information
  • TDR Targets ID: 1635659
  • Name: 7-chloro-3-(5-ethyl-1,3,4-thiadiazol-2-yl)-2- methylquinazolin-4-one
  • MW: 306.771 | Formula: C13H11ClN4OS
  • H donors: 0 H acceptors: 3 LogP: 2.67 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCc1nnc(s1)n1c(C)nc2c(c1=O)ccc(c2)Cl
  • InChi: 1S/C13H11ClN4OS/c1-3-11-16-17-13(20-11)18-7(2)15-10-6-8(14)4-5-9(10)12(18)19/h4-6H,3H2,1-2H3
  • InChiKey: XQYXBFXXUYLVNC-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 7-chloro-3-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-methyl-quinazolin-4-one
  • 7-chloro-3-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-methyl-4-quinazolinone
  • NCI60_038700
  • NSC709917

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
Onchocerca volvulus 0.0323 1 1
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.017 0.4796 0.4796
Schistosoma mansoni retinoic acid receptor RXR 0.0323 1 1
Echinococcus granulosus ecdysone induced protein 78C 0.0323 1 1
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0034 0.0133 0.0133
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0152 0.4172 0.4172
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0048 0.0614 0.0614
Loa Loa (eye worm) hypothetical protein 0.017 0.4796 0.4796
Loa Loa (eye worm) hypothetical protein 0.0104 0.2525 0.2525
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0323 1 1
Schistosoma mansoni hypothetical protein 0.0048 0.0614 0.0614
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0048 0.0614 0.0614
Brugia malayi hypothetical protein 0.0152 0.4172 0.4172
Brugia malayi tailless protein 0.0152 0.4172 0.4172
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0323 1 1
Loa Loa (eye worm) hypothetical protein 0.0152 0.4172 0.4172
Schistosoma mansoni steroid hormone receptor ad4bp 0.0323 1 1
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0152 0.4172 0.4172
Treponema pallidum NADH oxidase 0.0034 0.0133 0.5
Loa Loa (eye worm) hypothetical protein 0.0152 0.4172 0.4172
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0323 1 1
Brugia malayi glutathione reductase 0.0098 0.2331 0.2331
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.0034 0.0133 0.5
Schistosoma mansoni zinc finger protein 0.0152 0.4172 0.4172
Schistosoma mansoni nuclear receptor 0.0152 0.4172 0.4172
Onchocerca volvulus Bile acid receptor homolog 0.0323 1 1
Loa Loa (eye worm) nuclear receptor NHR-67 0.0152 0.4172 0.4172
Schistosoma mansoni coup transcription factor 0.0323 1 1
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.017 0.4796 0.4796
Schistosoma mansoni hypothetical protein 0.0048 0.0614 0.0614
Loa Loa (eye worm) hypothetical protein 0.017 0.4796 0.4796
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0048 0.0614 0.0614
Loa Loa (eye worm) hypothetical protein 0.0152 0.4172 0.4172
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0323 1 1
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0323 1 1
Brugia malayi hypothetical protein 0.017 0.4796 0.4796
Brugia malayi ecdysone receptor 0.0152 0.4172 0.4172
Trypanosoma brucei trypanothione reductase 0.0098 0.2331 1
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0323 1 1
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0323 1 1
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0152 0.4172 0.4172
Schistosoma mansoni jumonji/arid domain-containing protein 0.0037 0.0217 0.0217
Mycobacterium ulcerans flavoprotein disulfide reductase 0.0034 0.0133 0.5
Onchocerca volvulus 0.0152 0.4172 0.4172
Brugia malayi jmjC domain containing protein 0.0037 0.0217 0.0217
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0152 0.4172 0.4172
Plasmodium vivax thioredoxin reductase, putative 0.0098 0.2331 1
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0152 0.4172 0.4172
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0099 0.2348 0.2348
Echinococcus granulosus Nuclear hormone receptor HR96 0.0152 0.4172 0.4172
Trichomonas vaginalis mercuric reductase, putative 0.0034 0.0133 0.5
Loa Loa (eye worm) glutathione reductase 0.0098 0.2331 0.2331
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0323 1 1
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast 0.0034 0.0133 0.0572
Schistosoma mansoni hypothetical protein 0.0048 0.0614 0.0614
Echinococcus granulosus lysine specific demethylase 5A 0.0037 0.0217 0.0217
Echinococcus multilocularis jumonji domain containing protein 0.0042 0.0404 0.0404
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0072 0.1438 0.1438
Loa Loa (eye worm) hypothetical protein 0.0323 1 1
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0152 0.4172 0.4172
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0323 1 1
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0048 0.0614 0.0614
Brugia malayi nuclear hormone receptor family member nhr-6 0.0152 0.4172 0.4172
Schistosoma mansoni hypothetical protein 0.0048 0.0614 0.0614
Schistosoma mansoni thyroid hormone receptor 0.0323 1 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0323 1 1
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0323 1 1
Loa Loa (eye worm) nuclear receptor nhr-7B 0.0152 0.4172 0.4172
Loa Loa (eye worm) hypothetical protein 0.017 0.4796 0.4796
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0323 1 1
Schistosoma mansoni hypothetical protein 0.0104 0.2525 0.2525
Schistosoma mansoni transcription factor LCR-F1 0.0072 0.1438 0.1438
Schistosoma mansoni nuclear hormone receptor 0.0152 0.4172 0.4172
Loa Loa (eye worm) steroid hormone receptor 0.0323 1 1
Brugia malayi nuclear receptor NHR-88 0.0323 1 1
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0034 0.0133 0.0133
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial 0.0034 0.0133 0.0572
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0323 1 1
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0323 1 1
Schistosoma mansoni jumonji/arid domain-containing protein 0.0037 0.0217 0.0217
Brugia malayi photoreceptor-specific nuclear receptor 0.0323 1 1
Brugia malayi hypothetical protein 0.0072 0.1438 0.1438
Brugia malayi nuclear hormone receptor 0.0152 0.4172 0.4172
Brugia malayi hypothetical protein 0.0152 0.4172 0.4172
Brugia malayi Steroid receptor seven-up type 2 0.0323 1 1
Schistosoma mansoni jumonji domain containing protein 0.0079 0.1653 0.1653
Brugia malayi latrophilin 2 splice variant baaae 0.0104 0.2525 0.2525
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0224 0.6639 0.8837
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0323 1 1
Loa Loa (eye worm) hypothetical protein 0.0048 0.0614 0.0614
Loa Loa (eye worm) hypothetical protein 0.0152 0.4172 0.4172
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0224 0.6639 0.8837
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0224 0.6639 0.8837
Loa Loa (eye worm) hypothetical protein 0.0152 0.4172 0.4172
Schistosoma mansoni hypothetical protein 0.0072 0.1438 0.1438
Brugia malayi conserved hypotetical protein 0.0152 0.4172 0.4172
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0224 0.6639 0.8837
Trypanosoma cruzi trypanothione reductase, putative 0.0098 0.2331 1
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0152 0.4172 0.4172
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0323 1 1
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0323 1 1
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0098 0.2331 0.2985
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0323 1 1
Loa Loa (eye worm) transcription factor SMAD2 0.0125 0.3232 0.3232
Echinococcus multilocularis nuclear receptor nhr 48 0.0152 0.4172 0.4172
Giardia lamblia NADH oxidase lateral transfer candidate 0.0034 0.0133 1
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0048 0.0614 0.0614
Echinococcus multilocularis thioredoxin glutathione reductase 0.0098 0.2331 0.2331
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0323 1 1
Loa Loa (eye worm) latrophilin receptor protein 2 0.0048 0.0614 0.0614
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0034 0.0133 0.0133
Loa Loa (eye worm) thioredoxin reductase 0.0098 0.2331 0.2331
Loa Loa (eye worm) hypothetical protein 0.0152 0.4172 0.4172
Plasmodium falciparum glutathione reductase 0.0034 0.0133 0.0572
Loa Loa (eye worm) hypothetical protein 0.0323 1 1
Brugia malayi nuclear receptor RXR 0.017 0.4796 0.4796
Schistosoma mansoni thyroid hormone receptor 0.0323 1 1
Plasmodium falciparum thioredoxin reductase 0.0034 0.0133 0.0572
Loa Loa (eye worm) hypothetical protein 0.0152 0.4172 0.4172
Brugia malayi nuclear receptor NHR-88 0.0152 0.4172 0.4172
Loa Loa (eye worm) hypothetical protein 0.0323 1 1
Mycobacterium ulcerans dihydrolipoamide dehydrogenase, LpdB 0.0034 0.0133 0.5
Loa Loa (eye worm) hypothetical protein 0.0323 1 1
Loa Loa (eye worm) hypothetical protein 0.0152 0.4172 0.4172
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.017 0.4796 0.4796
Brugia malayi Nuclear hormone receptor E75 0.0152 0.4172 0.4172
Loa Loa (eye worm) hypothetical protein 0.0152 0.4172 0.4172
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.0152 0.4172 0.4172
Loa Loa (eye worm) hypothetical protein 0.0323 1 1
Loa Loa (eye worm) hypothetical protein 0.0152 0.4172 0.4172
Plasmodium falciparum thioredoxin reductase 0.0098 0.2331 1
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0323 1 1
Entamoeba histolytica hypothetical protein 0.0072 0.1438 0.5
Toxoplasma gondii NADPH-glutathione reductase 0.0034 0.0133 0.0572
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0034 0.0133 0.5
Brugia malayi Nuclear hormone receptor-like 1 0.017 0.4796 0.4796
Echinococcus granulosus jumonji domain containing protein 0.0042 0.0404 0.0404
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0323 1 1
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0034 0.0133 0.0572
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.0034 0.0133 0.0572
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0152 0.4172 0.4172
Loa Loa (eye worm) jmjC domain-containing protein 0.0037 0.0217 0.0217
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.017 0.4796 0.4796
Loa Loa (eye worm) MH2 domain-containing protein 0.0125 0.3232 0.3232
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0323 1 1
Plasmodium falciparum glutathione reductase 0.0098 0.2331 1
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0249 0.7495 1
Echinococcus multilocularis lysine specific demethylase 5A 0.0037 0.0217 0.0217
Loa Loa (eye worm) hypothetical protein 0.0152 0.4172 0.4172
Echinococcus multilocularis ecdysone induced protein 78C 0.0323 1 1
Loa Loa (eye worm) hypothetical protein 0.017 0.4796 0.4796
Brugia malayi nuclear receptor RXR 0.0152 0.4172 0.4172
Onchocerca volvulus Protein ultraspiracle homolog 0.0323 1 1
Echinococcus granulosus FTZ F1 alpha 0.0323 1 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0323 1 1
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0323 1 1
Loa Loa (eye worm) hypothetical protein 0.0152 0.4172 0.4172
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0323 1 1
Mycobacterium ulcerans dihydrolipoamide dehydrogenase 0.0034 0.0133 0.5
Schistosoma mansoni nuclear hormone receptor 0.0323 1 1
Loa Loa (eye worm) DR-78 0.0152 0.4172 0.4172
Mycobacterium tuberculosis Probable reductase 0.0224 0.6639 0.8837
Toxoplasma gondii thioredoxin reductase 0.0098 0.2331 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0323 1 1
Schistosoma mansoni nuclear receptor nhr-48 0.0152 0.4172 0.4172
Plasmodium vivax glutathione reductase, putative 0.0098 0.2331 1
Brugia malayi hypothetical protein 0.017 0.4796 0.4796
Loa Loa (eye worm) hypothetical protein 0.0052 0.0737 0.0737
Brugia malayi orphan nuclear receptor NR2E1 0.0152 0.4172 0.4172
Brugia malayi jmjC domain containing protein 0.0099 0.2348 0.2348
Echinococcus multilocularis thyroid hormone receptor alpha 0.0323 1 1
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0323 1 1
Loa Loa (eye worm) hypothetical protein 0.0152 0.4172 0.4172
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0323 1 1
Echinococcus multilocularis GPCR, family 2 0.0048 0.0614 0.0614
Echinococcus granulosus nuclear receptor nhr 48 0.0152 0.4172 0.4172
Echinococcus multilocularis FTZ F1 alpha 0.0323 1 1
Brugia malayi Thioredoxin reductase 0.0098 0.2331 0.2331
Schistosoma mansoni nuclear hormone receptor 0.0152 0.4172 0.4172
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.0152 0.4172 0.4172
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0034 0.0133 0.5
Brugia malayi nuclear hormone receptor 0.0323 1 1
Brugia malayi steroid hormone receptor 0.0323 1 1
Brugia malayi Nuclear hormone receptor E75 0.0152 0.4172 0.4172
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0323 1 1
Loa Loa (eye worm) hypothetical protein 0.0323 1 1
Brugia malayi Nuclear hormone receptor-like 1 0.0323 1 1
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0099 0.2348 0.2348
Echinococcus granulosus GPCR family 2 0.0048 0.0614 0.0614
Brugia malayi MH2 domain containing protein 0.0125 0.3232 0.3232
Mycobacterium tuberculosis Probable dehydrogenase 0.0224 0.6639 0.8837
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0249 0.7495 1
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0323 1 1
Loa Loa (eye worm) jmjC domain-containing protein 0.0062 0.1099 0.1099
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0152 0.4172 0.4172
Trichomonas vaginalis glutathione reductase, putative 0.0034 0.0133 0.5
Brugia malayi Calcitonin receptor-like protein seb-1 0.0152 0.4172 0.4172
Entamoeba histolytica hypothetical protein 0.0072 0.1438 0.5
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0323 1 1
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0072 0.1438 0.1438
Entamoeba histolytica hypothetical protein 0.0072 0.1438 0.5
Mycobacterium tuberculosis Probable oxidoreductase 0.0249 0.7495 1
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0323 1 1
Onchocerca volvulus 0.0152 0.4172 0.4172
Schistosoma mansoni RAR-like nuclear receptor 0.0323 1 1
Echinococcus granulosus thioredoxin glutathione reductase 0.0098 0.2331 0.2331
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0323 1 1
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0249 0.7495 1
Brugia malayi nuclear receptor NHR-67 0.0152 0.4172 0.4172
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0323 1 1
Loa Loa (eye worm) nuclear hormone receptor 0.0152 0.4172 0.4172
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.0152 0.4172 0.4172
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.0034 0.0133 0.0572
Brugia malayi Latrophilin receptor protein 2 0.0048 0.0614 0.0614
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0323 1 1
Schistosoma mansoni nuclear receptor 0.0152 0.4172 0.4172
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0323 1 1
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0034 0.0133 0.0133
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0323 1 1
Brugia malayi nuclear hormone receptor family member odr-7 0.0152 0.4172 0.4172
Brugia malayi Nuclear hormone receptor-like 1 0.017 0.4796 0.4796
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0323 1 1
Loa Loa (eye worm) hypothetical protein 0.017 0.4796 0.4796
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0152 0.4172 0.4172
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.0152 0.4172 0.4172
Loa Loa (eye worm) hypothetical protein 0.0323 1 1
Loa Loa (eye worm) hypothetical protein 0.0152 0.4172 0.4172
Schistosoma mansoni retinoid-x-receptor (RXR) 0.017 0.4796 0.4796
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0323 1 1
Entamoeba histolytica hypothetical protein 0.0072 0.1438 0.5
Echinococcus granulosus Nuclear hormone receptor HR96 0.0152 0.4172 0.4172
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0323 1 1
Echinococcus granulosus thyroid hormone receptor alpha 0.0152 0.4172 0.4172
Leishmania major trypanothione reductase 0.0098 0.2331 1
Loa Loa (eye worm) hypothetical protein 0.0323 1 1

Activities

Activity type Activity value Assay description Source Reference
GI50 (functional) -4.877 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MDA-N Breast cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.796 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MALME-3M Melanoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.671 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SK-MEL-5 Melanoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.568 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HOP-92 Non-Small Cell Lung cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.501 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the UO-31 Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.5 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the NCI-H23 Non-Small Cell Lung cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.471 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the ACHN Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.466 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SN12C Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.387 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HL-60(TB) Leukemia cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.381 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the DU-145 Prostate cell line. (Class of assay: confirmatory) ChEMBL. 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.

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