Detailed information for compound 1648344

Basic information

Technical information
  • TDR Targets ID: 1648344
  • Name: [4-[(E)-(1,3-benzothiazol-2-ylhydrazinylidene )methyl]-2-methoxyphenyl] 2-fluorobenzoate
  • MW: 421.444 | Formula: C22H16FN3O3S
  • H donors: 1 H acceptors: 2 LogP: 5.81 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1cc(/C=N/Nc2nc3c(s2)cccc3)ccc1OC(=O)c1ccccc1F
  • InChi: 1S/C22H16FN3O3S/c1-28-19-12-14(13-24-26-22-25-17-8-4-5-9-20(17)30-22)10-11-18(19)29-21(27)15-6-2-3-7-16(15)23/h2-13H,1H3,(H,25,26)/b24-13+
  • InChiKey: AVHKYPAXEWRMIX-ZMOGYAJESA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • [4-[(1,3-benzothiazol-2-ylhydrazinylidene)methyl]-2-methoxyphenyl] 2-fluorobenzoate
  • [4-[(E)-(1,3-benzothiazol-2-ylhydrazono)methyl]-2-methoxy-phenyl] 2-fluorobenzoate
  • [4-[(1,3-benzothiazol-2-ylhydrazono)methyl]-2-methoxy-phenyl] 2-fluorobenzoate
  • 2-fluorobenzoic acid [4-[(E)-(1,3-benzothiazol-2-ylhydrazono)methyl]-2-methoxyphenyl] ester
  • 2-fluorobenzoic acid [4-[(1,3-benzothiazol-2-ylhydrazono)methyl]-2-methoxyphenyl] ester
  • 2-fluorobenzoic acid [4-[(E)-(1,3-benzothiazol-2-ylhydrazono)methyl]-2-methoxy-phenyl] ester
  • 2-fluorobenzoic acid [4-[(1,3-benzothiazol-2-ylhydrazono)methyl]-2-methoxy-phenyl] ester
  • [4-[(E)-(1,3-benzothiazol-2-ylhydrazinylidene)methyl]-2-methoxy-phenyl] 2-fluorobenzoate
  • [4-[(1,3-benzothiazol-2-ylhydrazinylidene)methyl]-2-methoxy-phenyl] 2-fluorobenzoate
  • MLS000418023
  • SMR000264855
  • T0520-4517

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens v-rel avian reticuloendotheliosis viral oncogene homolog A No references
Homo sapiens nuclear factor of kappa light polypeptide gene enhancer in B-cells 1 Starlite/ChEMBL No references
Homo sapiens multiple endocrine neoplasia I No references
Homo sapiens microtubule-associated protein tau Starlite/ChEMBL No references
Homo sapiens ATPase family, AAA domain containing 5 Starlite/ChEMBL No references
Homo sapiens lysine (K)-specific methyltransferase 2A Starlite/ChEMBL No references
Homo sapiens nuclear factor of kappa light polypeptide gene enhancer in B-cells 2 (p49/p100) No references
Homo sapiens tumor protein p53 Starlite/ChEMBL No references
Homo sapiens RAB9A, member RAS oncogene family Starlite/ChEMBL No references
Homo sapiens nuclear factor, erythroid 2-like 2 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus multilocularis microtubule associated protein 2 Get druggable targets OG5_133504 All targets in OG5_133504
Schistosoma japonicum ko:K09188 myeloid/lymphoid or mixed-lineage leukemia protein 3, putative Get druggable targets OG5_130642 All targets in OG5_130642
Echinococcus granulosus microtubule associated protein 2 Get druggable targets OG5_133504 All targets in OG5_133504
Neospora caninum Multidomain chromatinic protein with the following architecture: 3x PHD-bromo-3xPHD-SET domain and associated cysteine cluster a Get druggable targets OG5_130642 All targets in OG5_130642
Schistosoma japonicum ko:K04380 microtubule-associated protein tau, putative Get druggable targets OG5_133504 All targets in OG5_133504
Echinococcus granulosus tumor protein p63 Get druggable targets OG5_140038 All targets in OG5_140038
Schistosoma mansoni hypothetical protein Get druggable targets OG5_133913 All targets in OG5_133913
Echinococcus granulosus dnaJ subfamily B Get druggable targets OG5_133913 All targets in OG5_133913
Toxoplasma gondii histone lysine methyltransferase SET1 Get druggable targets OG5_130642 All targets in OG5_130642
Echinococcus multilocularis tumor protein p63 Get druggable targets OG5_140038 All targets in OG5_140038
Echinococcus multilocularis dnaJ subfamily B Get druggable targets OG5_133913 All targets in OG5_133913
Schistosoma mansoni mixed-lineage leukemia protein mll Get druggable targets OG5_130642 All targets in OG5_130642
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core Get druggable targets OG5_139225 All targets in OG5_139225
Schistosoma mansoni microtubule-associated protein tau Get druggable targets OG5_133504 All targets in OG5_133504
Schistosoma japonicum Menin, putative Get druggable targets OG5_133913 All targets in OG5_133913
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Plasmodium falciparum ras-related protein Rab-5B RAB9A, member RAS oncogene family 201 aa 165 aa 30.9 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Brugia malayi Uncoordinated protein 44 0.0038 0.013 0.7967
Schistosoma mansoni transcription factor LCR-F1 0.0043 0.0149 0.0148
Trichomonas vaginalis hypothetical protein 0.0004 0.0002 0.0138
Entamoeba histolytica hypothetical protein 0.0043 0.0149 1
Echinococcus multilocularis ankyrin repeat and death domain containing protein 0.0038 0.013 0.0111
Treponema pallidum N-acetylphosphinothricin-tripetide-deacetylase 0.0045 0.0156 0.5
Onchocerca volvulus 0.006 0.021 1
Mycobacterium tuberculosis Probable lipase LipH 0.0045 0.0156 0.5
Trichomonas vaginalis Esterase, putative 0.0045 0.0156 1
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0074 0.0262 0.026
Schistosoma mansoni netrin receptor unc5 0.0038 0.013 0.0128
Trypanosoma cruzi Isoprenylcysteine alpha-carbonyl methylesterase, putative 0.0045 0.0156 1
Mycobacterium tuberculosis Probable esterase/lipase LipF 0.0045 0.0156 0.5
Schistosoma mansoni hypothetical protein 0.0494 0.1838 0.1837
Echinococcus granulosus microtubule associated protein 2 0.0833 0.311 0.3097
Toxoplasma gondii histone lysine methyltransferase SET1 0.0066 0.0233 1
Mycobacterium tuberculosis Probable acetyl-hydrolase/esterase LipR 0.0045 0.0156 0.5
Schistosoma mansoni hypothetical protein 0.0038 0.013 0.0128
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0016 0.1014
Entamoeba histolytica hypothetical protein 0.0043 0.0149 1
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0016 0.1014
Echinococcus multilocularis hormone sensitive lipase 0.2671 1 1
Schistosoma mansoni retinoblastoma-binding protein 4 (rbbp4) 0.0038 0.013 0.0128
Mycobacterium ulcerans esterase LipO 0.0045 0.0156 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0016 0.1014
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0008 0.0016 0.1014
Mycobacterium tuberculosis Probable esterase LipC 0.0045 0.0156 0.5
Trichomonas vaginalis helicase, putative 0.0008 0.0016 0.1014
Echinococcus multilocularis cpg binding protein 0.0037 0.0124 0.0105
Mycobacterium ulcerans lipase LipU 0.0045 0.0156 0.5
Mycobacterium leprae Possible lipase LipU 0.0045 0.0156 0.5
Brugia malayi hypothetical protein 0.0043 0.0149 0.9482
Schistosoma mansoni hormone-sensitive lipase (S09 family) 0.2671 1 1
Mycobacterium ulcerans carboxylesterase LipQ 0.0045 0.0156 0.5
Mycobacterium tuberculosis Possible lipase LipU 0.0045 0.0156 0.5
Schistosoma mansoni ankyrin 23/unc44 0.0038 0.013 0.0128
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0016 0.1014
Trichomonas vaginalis Esterase, putative 0.0045 0.0156 1
Echinococcus granulosus dnaJ subfamily B 0.0494 0.1838 0.1823
Echinococcus multilocularis Ankyrin 0.0038 0.013 0.0112
Echinococcus multilocularis microtubule associated protein 2 0.0833 0.311 0.3097
Loa Loa (eye worm) ammd protein 0.0045 0.0156 0.013
Schistosoma mansoni cpg binding protein 0.0037 0.0124 0.0122
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0016 0.1014
Mycobacterium tuberculosis Probable esterase LipO 0.0045 0.0156 0.5
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0016 0.1014
Mycobacterium ulcerans lipase/esterase LipN 0.0045 0.0156 0.5
Mycobacterium tuberculosis Probable esterase LipM 0.0045 0.0156 0.5
Echinococcus multilocularis dnaJ subfamily B 0.0494 0.1838 0.1823
Loa Loa (eye worm) CXXC zinc finger family protein 0.0035 0.0116 0.009
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0005 0.0005 0.0003
Mycobacterium tuberculosis Probable lipase/esterase LipN 0.0045 0.0156 0.5
Trypanosoma brucei Isoprenylcysteine alpha-carbonyl methylesterase, putative 0.0045 0.0156 1
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0016 0.1014
Brugia malayi aryl-acylamidase 0.0045 0.0156 1
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0038 0.013 0.0103
Entamoeba histolytica hypothetical protein 0.0043 0.0149 1
Schistosoma mansoni cpg binding protein 0.0035 0.0116 0.0115
Echinococcus multilocularis nuclear factor of activated T cells 5 0.0374 0.1386 0.137
Leishmania major ecotin, putative 0.0045 0.0156 0.5
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0011 0.0027 0.0008
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0016 0.1014
Trypanosoma cruzi Alpha/beta hydrolase domain-containing protein 0.0045 0.0156 1
Loa Loa (eye worm) hypothetical protein 0.0038 0.013 0.0103
Echinococcus granulosus death domain containing protein 0.0038 0.013 0.0111
Mycobacterium ulcerans esterase LipC 0.0045 0.0156 0.5
Plasmodium falciparum zinc finger protein, putative 0.0004 0.0002 0.5
Mycobacterium ulcerans lipase LipH 0.0045 0.0156 0.5
Onchocerca volvulus Netrin receptor homolog 0.0038 0.013 0.1403
Mycobacterium ulcerans lipase LipU 0.0045 0.0156 0.5
Mycobacterium ulcerans esterase/lipase 0.0045 0.0156 0.5
Echinococcus granulosus cpg binding protein 0.0037 0.0124 0.0105
Mycobacterium ulcerans hypothetical protein 0.0045 0.0156 0.5
Leishmania major hypothetical protein, conserved 0.0045 0.0156 0.5
Schistosoma mansoni cellular tumor antigen P53 0.006 0.021 0.0209
Echinococcus multilocularis netrin receptor unc 5 0.0038 0.013 0.0111
Echinococcus granulosus tumor protein p63 0.0408 0.1516 0.15
Brugia malayi Death domain containing protein 0.0038 0.013 0.7967
Onchocerca volvulus 0.0045 0.0156 0.4216
Trichomonas vaginalis conserved hypothetical protein 0.0004 0.0002 0.0138
Brugia malayi Immunoglobulin I-set domain containing protein 0.0038 0.013 0.7967
Schistosoma mansoni hypothetical protein 0.0043 0.0149 0.0148
Echinococcus granulosus nuclear factor of activated T cells 5 0.0374 0.1386 0.137
Schistosoma mansoni hormone-sensitive lipase (S09 family) 0.2671 1 1
Trichomonas vaginalis Esterase, putative 0.0045 0.0156 1
Trichomonas vaginalis conserved hypothetical protein 0.0045 0.0156 1
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0043 0.0149 0.0131
Mycobacterium ulcerans acetyl hydrolase MbtJ 0.0045 0.0156 0.5
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0016 0.1014
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0016 0.1014
Loa Loa (eye worm) hypothetical protein 0.2671 1 1
Mycobacterium tuberculosis Probable carboxylesterase LipQ 0.0045 0.0156 0.5
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0008 0.0016 0.1014
Mycobacterium tuberculosis Possible esterase LipW 0.0045 0.0156 0.5
Mycobacterium tuberculosis Putative acetyl hydrolase MbtJ 0.0045 0.0156 0.5
Echinococcus granulosus netrin receptor unc 5 0.0038 0.013 0.0111
Schistosoma mansoni microtubule-associated protein tau 0.0833 0.311 0.3109
Loa Loa (eye worm) aryl-acylamidase 0.0045 0.0156 0.013
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0016 0.1014
Schistosoma mansoni cpg binding protein 0.0037 0.0124 0.0122
Loa Loa (eye worm) hypothetical protein 0.0038 0.013 0.0104
Mycobacterium ulcerans membrane-bound esterase LipM 0.0045 0.0156 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0016 0.1014
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0979 0.3657 0.3645
Trypanosoma cruzi Isoprenylcysteine alpha-carbonyl methylesterase, putative 0.0045 0.0156 1
Entamoeba histolytica hypothetical protein 0.0043 0.0149 1
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0011 0.0027 0.0008
Mycobacterium ulcerans esterase LipW 0.0045 0.0156 0.5
Schistosoma mansoni hormone-sensitive lipase (S09 family) 0.2671 1 1
Brugia malayi CXXC zinc finger family protein 0.0035 0.0116 0.6953
Brugia malayi Protein kinase domain containing protein 0.0038 0.013 0.7967
Loa Loa (eye worm) hypothetical protein 0.006 0.021 0.0184
Echinococcus granulosus Ankyrin 0.0038 0.013 0.0112
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0009 0.0019 0.0017
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0043 0.0149 0.0131
Mycobacterium tuberculosis Probable non lipolytic carboxylesterase NlhH 0.0045 0.0156 0.5
Echinococcus granulosus ankyrin repeat and death domain containing protein 0.0038 0.013 0.0111
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0016 0.1014
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0016 0.1014
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0016 0.1014
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0045 0.0156 0.0154
Trypanosoma cruzi serine peptidase, Clan SC, Family S9D 0.0045 0.0156 1
Mycobacterium ulcerans lipase LipI 0.0045 0.0156 0.5
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0004 0.0002 0.0138
Echinococcus multilocularis tumor protein p63 0.0408 0.1516 0.15

Activities

Activity type Activity value Assay description Source Reference
EC50 (functional) = 1.417 um PUBCHEM_BIOASSAY: Name: High Throughput Screen to Identify Compounds that increase expression of NF-kB in Human Neuronal Cells - Dose Response. (Class of assay: confirmatory) [Related pubchem assays: 1239 ] ChEMBL. No reference
Potency (functional) 1.3115 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 1.4581 uM PubChem BioAssay. qHTS assay for re-activators of p53 using a Luc reporter: Hit Validation. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 2.3323 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) = 4.4668 um PUBCHEM_BIOASSAY: qHTS Assay for Rab9 Promoter Activators. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 4.6109 uM PubChem BioAssay. qHTS of Nrf2 Activators: Hit Validation in Primary Assay. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 5.3582 uM PubChem BioAssay. qHTS of Nrf2 Activators: Hit Validation in Secondary FLuc Assay. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 5.6234 uM PubChem BioAssay. qHTS of Nrf2 Activators. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 6.3096 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors Targeting the Menin-MLL Interaction in MLL Related Leukemias: Competition With Texas Red Labeled MLL-derived Mutant Peptide. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 6.5131 uM PUBCHEM_BIOASSAY: qHTS screen for small molecules that induce genotoxicity in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493106, AID493143] ChEMBL. No reference
Potency (functional) 6.5131 uM PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125] ChEMBL. No reference
Potency (functional) = 7.0795 um PUBCHEM_BIOASSAY: Counterscreen qHTS for Inhibitors of Tau Fibril Formation, Fluorescence Polarization. This assay monitors tau fibrillation by fluorescence polarization (FP) of Alexa 594-labeled K18 P301L, which does not fibrillize readily but incorporates into growing filaments of unlabeled tau. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (binding) = 7.9433 um PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Thioflavin T Binding. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (functional) 20.5962 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in MCF 10a normal breast cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 20.5962 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in SW480 colon adenocarcinoma cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 25.1189 um PUBCHEM_BIOASSAY: qHTS Assay for Enhancers of SMN2 Splice Variant Expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 25.929 uM PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648] ChEMBL. No reference
Potency (functional) 25.929 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of RanGTP induced Rango (Ran-regulated importin-beta cargo) - Importin beta complex dissociation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID540262] ChEMBL. No reference
Potency (functional) 26.8545 uM PUBCHEM_BIOASSAY: qHTS profiling assay for firefly luciferase inhibitor/activator using purified enzyme and Km concentrations of substrates (counterscreen for miR-21 project). (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2288, AID2289, AID2598, AID411] ChEMBL. No reference
Potency (functional) 28.1838 uM PubChem BioAssay. qHTS of PTHR Inhibitors: Primary Screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: VP16 counterscreen qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 35.4813 uM PubChem BioAssay. qHTS for Inhibitors of Vif-A3G Interactions: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 35.4813 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of binding or entry into cells for Lassa Virus. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID463114, AID540249] ChEMBL. No reference
Potency (functional) = 39.8107 um PUBCHEM_BIOASSAY: qHTS Assay for Promiscuous and Specific Inhibitors of Cruzain (without detergent). (Class of assay: confirmatory) [Related pubchem assays: 2158 (Confirmation qHTS Assay for Inhibitors of Cruzain), 2249 (Probe Development Summary of Promiscuous Inhibitors (Artifacts) of Cruzain), 2161 (qHTS Assay for Inhibitors of Papain: Counterscreen for Cruzain Assay), 1478 (qHTS Assay for Promiscuous and Specific Inhibitors of Cruzain (with detergent))] ChEMBL. No reference
Potency (functional) = 39.8107 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human alpha-Glucosidase as a Potential Chaperone Treatment of Pompe Disease. (Class of assay: confirmatory) [Related pubchem assays: 997 ] ChEMBL. No reference
Potency (functional) = 39.8107 um PUBCHEM_BIOASSAY: qHTS Assay for Activators of Human alpha-Glucosidase as a Potential Chaperone Treatment of Pompe Disease. (Class of assay: confirmatory) [Related pubchem assays: 1467, 2100, 2112, 1473, 1466 ] ChEMBL. No reference
Potency (functional) 39.8107 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] ChEMBL. No reference
Potency (functional) 50.1187 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of JMJD2A-Tudor Domain. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504402] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23

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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