Detailed information for compound 1607541

Basic information

Technical information
  • TDR Targets ID: 1607541
  • Name: 2,4-dicyano-3-(2,6-dichlorophenyl)glutaric ac id
  • MW: 327.12 | Formula: C13H8Cl2N2O4
  • H donors: 2 H acceptors: 6 LogP: 2.2 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: N#CC(C(c1c(Cl)cccc1Cl)C(C(=O)O)C#N)C(=O)O
  • InChi: 1S/C13H8Cl2N2O4/c14-8-2-1-3-9(15)11(8)10(6(4-16)12(18)19)7(5-17)13(20)21/h1-3,6-7,10H,(H,18,19)(H,20,21)
  • InChiKey: YPZJRLVFKBMTMP-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • NSC342054
  • 2,4-dicyano-3-(2,6-dichlorophenyl)pentanedioic acid
  • NCI60_003035

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 multilocularis transient receptor potential cation channel 0.0501 0.4973 1
Trypanosoma brucei beta-ketoacyl-ACP reductase 0.0025 0.0118 1
Schistosoma mansoni tar DNA-binding protein 0.0062 0.0493 0.0449
Mycobacterium ulcerans amidase 0.0025 0.0111 0.0179
Echinococcus multilocularis ankyrin repeat protein 0.0487 0.4832 0.9716
Mycobacterium ulcerans short chain dehydrogenase 0.0025 0.0118 0.0196
Onchocerca volvulus 0.0077 0.0642 1
Loa Loa (eye worm) amidase 0.0025 0.0111 0.0404
Brugia malayi TAR-binding protein 0.0062 0.0493 0.1789
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0025 0.0118 0.0196
Mycobacterium ulcerans 20-beta-hydroxysteroid dehydrogenase FabG3 0.0025 0.0118 0.0196
Mycobacterium tuberculosis Possible oxidoreductase 0.0025 0.0118 0.0196
Echinococcus granulosus glutamyl tRNAGln amidotransferase subunit A 0.0025 0.0111 0.0224
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0077 0.0642 0.0598
Mycobacterium ulcerans short chain dehydrogenase 0.0025 0.0118 0.0196
Plasmodium falciparum plasmepsin II 0.0077 0.0642 0.1639
Plasmodium falciparum histone acetyltransferase GCN5 0.0076 0.064 0.1634
Plasmodium falciparum plasmepsin V 0.0077 0.0642 0.1639
Plasmodium vivax enoyl-acyl carrier protein reductase 0.0374 0.368 1
Mycobacterium tuberculosis NADH-dependent enoyl-[acyl-carrier-protein] reductase InhA (NADH-dependent enoyl-ACP reductase) 0.0374 0.368 1
Plasmodium vivax kinesin-5 0.0052 0.0387 0.0937
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0284 0.2757 0.2723
Mycobacterium tuberculosis Probable oxidoreductase 0.0025 0.0118 0.0196
Mycobacterium ulcerans amidase 0.0025 0.0111 0.0179
Loa Loa (eye worm) oxidoreductase 0.0025 0.0118 0.0426
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0077 0.0642 0.0598
Mycobacterium tuberculosis Probable amidase AmiD (acylamidase) (acylase) 0.0025 0.0111 0.0179
Chlamydia trachomatis oxoacy-ACP reductase 0.0025 0.0118 0.0177
Mycobacterium tuberculosis Possible amidase (aminohydrolase) 0.0025 0.0111 0.0179
Leishmania major dehydrogenase/oxidoreductase-like protein 0.0025 0.0118 1
Mycobacterium tuberculosis Probable amidase AmiA2 (aminohydrolase) 0.0025 0.0111 0.0179
Wolbachia endosymbiont of Brugia malayi aspartyl/glutamyl-tRNA amidotransferase subunit A 0.0025 0.0111 0.0179
Toxoplasma gondii aspartyl protease ASP3 0.0077 0.0642 0.1639
Treponema pallidum amino acid ABC transporter, periplasmic binding protein (hisJ) 0.0019 0.0054 0.1091
Schistosoma mansoni amidase 0.0205 0.1953 0.1916
Schistosoma mansoni fatty-acid amide hydrolase 0.0205 0.1953 0.1916
Plasmodium vivax aspartyl protease, putative 0.0077 0.0642 0.1639
Mycobacterium ulcerans amidase 0.0025 0.0111 0.0179
Schistosoma mansoni glutamyl-tRNA(Gln) amidotransferase subunit A 0.0025 0.0111 0.0065
Loa Loa (eye worm) hypothetical protein 0.0025 0.0118 0.0426
Trichomonas vaginalis hypothetical protein 0.0374 0.368 1
Brugia malayi Kinesin motor domain containing protein 0.0052 0.0387 0.1404
Loa Loa (eye worm) retinol dehydrogenase 12 0.0025 0.0118 0.0426
Plasmodium falciparum plasmepsin I 0.0077 0.0642 0.1639
Echinococcus multilocularis fatty acid amide hydrolase 1 0.0025 0.0111 0.0224
Echinococcus granulosus histone acetyltransferase KAT2B 0.0276 0.2675 0.5388
Trypanosoma cruzi beta-ketoacyl-ACP reductase 0.0025 0.0118 1
Echinococcus granulosus transient receptor potential cation channel 0.05 0.4965 1
Brugia malayi hypothetical protein 0.0077 0.0642 0.2329
Entamoeba histolytica kinesin, putative 0.0052 0.0387 0.5739
Trypanosoma brucei pteridine reductase 1 0.0025 0.0118 1
Schistosoma mansoni tar DNA-binding protein 0.0062 0.0493 0.0449
Schistosoma mansoni tar DNA-binding protein 0.0062 0.0493 0.0449
Brugia malayi Amidase family protein 0.0025 0.0111 0.0404
Mycobacterium tuberculosis Probable dehydrogenase/reductase 0.0025 0.0118 0.0196
Leishmania major hypothetical protein, conserved 0.0025 0.0111 0.9141
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0284 0.2757 0.5543
Mycobacterium ulcerans short chain dehydrogenase 0.0025 0.0118 0.0196
Loa Loa (eye worm) kinesin-like protein KLP2 0.0052 0.0387 0.1404
Leishmania major 3-oxoacyl-ACP reductase, putative 0.0025 0.0118 1
Mycobacterium tuberculosis Probable 3-oxoacyl-[acyl-carrier protein] reductase FabG2 (3-ketoacyl-acyl carrier protein reductase) 0.0025 0.0118 0.0196
Trypanosoma brucei fatty-acid amide hydrolase, putative 0.0025 0.0111 0.9141
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0025 0.0118 0.0196
Mycobacterium ulcerans 3-ketoacyl-ACP reductase 0.0025 0.0118 0.0196
Plasmodium falciparum plasmepsin III 0.0077 0.0642 0.1639
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0077 0.0642 0.0598
Mycobacterium ulcerans amidase 0.0025 0.0111 0.0179
Schistosoma mansoni dihydropteridine reductase 0.0025 0.0118 0.0071
Loa Loa (eye worm) acetyltransferase 0.0284 0.2757 1
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0025 0.0118 0.0196
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0077 0.0642 0.0598
Toxoplasma gondii kinesin motor domain-containing protein 0.0052 0.0387 0.0937
Brugia malayi hypothetical protein 0.0077 0.0642 0.2329
Plasmodium vivax 3-oxoacyl-[acyl-carrier-protein] reductase, putative 0.0025 0.0118 0.0196
Mycobacterium ulcerans 3-ketoacyl-ACP reductase 0.0025 0.0118 0.0196
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0025 0.0118 0.0196
Loa Loa (eye worm) aspartic protease BmAsp-2 0.0077 0.0642 0.2329
Schistosoma mansoni cathepsin D (A01 family) 0.0077 0.0642 0.0598
Echinococcus multilocularis tar DNA binding protein 0.0062 0.0493 0.0992
Loa Loa (eye worm) aspartic protease BmAsp-1 0.0077 0.0642 0.2329
Echinococcus granulosus nmda type glutamate receptor 0.0027 0.0129 0.0261
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0083 0.0711 0.1829
Schistosoma mansoni hypothetical protein 0.0346 0.3397 0.3366
Loa Loa (eye worm) aspartyl protease 6 0.0077 0.0642 0.2329
Schistosoma mansoni fatty-acid amide hydrolase 0.0025 0.0111 0.0065
Entamoeba histolytica 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0025 0.0118 0.1199
Chlamydia trachomatis glutamyl-tRNA(Gln) amidotransferase subunit A 0.0025 0.0111 0.016
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0018 0.0046 0.0093
Chlamydia trachomatis enoyl-acyl-carrier protein reductase 0.0374 0.368 1
Trypanosoma brucei oxidoreductase-like protein 0.0025 0.0118 1
Mycobacterium ulcerans short chain dehydrogenase 0.0025 0.0118 0.0196
Wolbachia endosymbiont of Brugia malayi Short-chain alcohol dehydrogenase family enzyme 0.0025 0.0118 0.0196
Schistosoma mansoni transient receptor potential cation channel subfamily A member 0.0487 0.4832 0.4808
Trypanosoma cruzi amidase, putative 0.0025 0.0111 0.9141
Brugia malayi exodeoxyribonuclease III family protein 0.0018 0.0046 0.0168
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0025 0.0118 0.0196
Toxoplasma gondii eukaryotic aspartyl protease superfamily protein 0.0077 0.0642 0.1639
Mycobacterium ulcerans short chain dehydrogenase 0.0025 0.0118 0.0196
Wolbachia endosymbiont of Brugia malayi enoyl-ACP reductase 0.0374 0.368 1
Brugia malayi aspartic protease BmAsp-2, identical 0.0077 0.0642 0.2329
Plasmodium vivax aspartyl proteinase, putative 0.0077 0.0642 0.1639
Mycobacterium ulcerans 3-oxoacyl-ACP reductase 0.0025 0.0118 0.0196
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0025 0.0118 0.0426
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0077 0.0642 0.0598
Echinococcus granulosus histone acetyltransferase KAT2B 0.0083 0.0711 0.1432
Toxoplasma gondii aspartyl proteinase (eimepsin), putative 0.0077 0.0642 0.1639
Toxoplasma gondii 2,4-dienoyl CoA reductase 2, peroxisomal family protein 0.0025 0.0118 0.0196
Mycobacterium ulcerans peptide amidase, GatA 0.0025 0.0111 0.0179
Loa Loa (eye worm) 3-hydroxyacyl-CoA dehydrogenase type II 0.0025 0.0118 0.0426
Mycobacterium tuberculosis Possible oxidoreductase 0.0025 0.0118 0.0196
Mycobacterium ulcerans short chain dehydrogenase 0.0025 0.0118 0.0196
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0083 0.0711 0.1829
Loa Loa (eye worm) RNA binding protein 0.0062 0.0493 0.1789
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0018 0.0046 0.0093
Leishmania major dehydrogenase/oxidoreductase-like protein 0.0025 0.0118 1
Echinococcus multilocularis glutamyl tRNA(Gln) amidotransferase subunit A 0.0025 0.0111 0.0224
Echinococcus multilocularis kinesin family 1 0.0398 0.3925 0.7892
Mycobacterium ulcerans glutamine-binding lipoprotein GlnH 0.0019 0.0054 0.002
Giardia lamblia Histone acetyltransferase GCN5 0.0076 0.064 1
Mycobacterium ulcerans short chain dehydrogenase 0.0025 0.0118 0.0196
Plasmodium falciparum kinesin-5 0.0052 0.0387 0.0937
Mycobacterium ulcerans short chain dehydrogenase 0.0025 0.0118 0.0196
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 3 0.0027 0.0129 0.026
Brugia malayi Pepsin A precursor 0.0077 0.0642 0.2329
Schistosoma mansoni tar DNA-binding protein 0.0062 0.0493 0.0449
Echinococcus multilocularis 3 oxoacyl acyl carrier protein reductase 0.0025 0.0118 0.0236
Leishmania major oxidoreductase-like protein 0.0025 0.0118 1
Treponema pallidum amino acid ABC transporter, periplasmic binding protein 0.0019 0.0054 0.1091
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0025 0.0118 0.0196
Brugia malayi RNA recognition motif domain containing protein 0.0062 0.0493 0.1789
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0025 0.0118 0.0196
Brugia malayi Eukaryotic aspartyl protease family protein 0.0077 0.0642 0.2329
Plasmodium vivax glutamyl-tRNA(Gln) amidotransferase subunit A, putative 0.0025 0.0111 0.0179
Plasmodium falciparum plasmepsin VII 0.0077 0.0642 0.1639
Toxoplasma gondii short chain dehydrogenase family protein, putative 0.0025 0.0118 0.0196
Trypanosoma cruzi beta-ketoacyl-ACP reductase 0.0025 0.0118 1
Toxoplasma gondii aspartyl protease ASP1 0.0077 0.0642 0.1639
Echinococcus granulosus cathepsin d lysosomal aspartyl protease 0.0077 0.0642 0.1293
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0077 0.0642 0.0598
Echinococcus granulosus 3 oxoacyl acyl carrier protein reductase 0.0025 0.0118 0.0237
Mycobacterium ulcerans 3-ketoacyl-ACP reductase 0.0025 0.0118 0.0196
Brugia malayi RNA binding protein 0.0062 0.0493 0.1789
Brugia malayi acetyltransferase, GNAT family protein 0.0284 0.2757 1
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0025 0.0118 0.0196
Trichomonas vaginalis bromodomain-containing protein, putative 0.0083 0.0711 0.1829
Mycobacterium tuberculosis Probable amidase AmiC (aminohydrolase) 0.0025 0.0111 0.0179
Mycobacterium ulcerans aspartyl/glutamyl-tRNA amidotransferase subunit A 0.0025 0.0111 0.0179
Toxoplasma gondii enoyl-acyl carrier reductase ENR 0.0374 0.368 1
Brugia malayi putative amidase 0.0025 0.0111 0.0404
Plasmodium vivax plasmepsin IV, putative 0.0077 0.0642 0.1639
Toxoplasma gondii aspartyl protease 0.0077 0.0642 0.1639
Echinococcus granulosus kinesin family 1 0.0398 0.3925 0.7905
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0025 0.0118 0.0196
Entamoeba histolytica acetyltransferase, GNAT family 0.0076 0.064 1
Mycobacterium ulcerans 3-alpha-hydroxysteroid dehydrogenase 0.0025 0.0118 0.0196
Loa Loa (eye worm) hypothetical protein 0.0077 0.0642 0.2329
Trypanosoma cruzi amidase, putative 0.0025 0.0111 0.9141
Brugia malayi Amidase family protein 0.0025 0.0111 0.0404
Echinococcus multilocularis fatty acid amide hydrolase 1 0.0205 0.1953 0.3928
Echinococcus multilocularis fatty acid amide hydrolase 1 0.0205 0.1953 0.3928
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0077 0.0642 0.0598
Giardia lamblia Kinesin-5 0.0052 0.0387 0.5739
Echinococcus granulosus fatty acid amide hydrolase 1 0.0205 0.1953 0.3934
Mycobacterium ulcerans amidase 0.0025 0.0111 0.0179
Mycobacterium ulcerans short chain dehydrogenase 0.0025 0.0118 0.0196
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0025 0.0118 0.0426
Schistosoma mansoni 3-oxoacyl-[ACP] reductase 0.0025 0.0118 0.0071
Toxoplasma gondii 3-ketoacyl-(acyl-carrier-protein) reductase 0.0025 0.0118 0.0196
Plasmodium falciparum enoyl-acyl carrier reductase 0.0374 0.368 1
Plasmodium falciparum plasmepsin IX 0.0077 0.0642 0.1639
Echinococcus multilocularis cathepsin d (lysosomal aspartyl protease) 0.0077 0.0642 0.1291
Mycobacterium ulcerans oxidoreductase 0.0025 0.0118 0.0196
Echinococcus granulosus ankyrin repeat protein 0.0487 0.4832 0.9731
Brugia malayi amidase 0.0205 0.1953 0.7087
Mycobacterium ulcerans short chain dehydrogenase 0.0025 0.0118 0.0196
Onchocerca volvulus 0.0077 0.0642 1
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0083 0.0711 0.1829
Echinococcus granulosus fatty acid amide hydrolase 1 0.0025 0.0111 0.0224
Loa Loa (eye worm) hypothetical protein 0.0077 0.0642 0.2329
Mycobacterium leprae POSSIBLE OXIDOREDUCTASE 0.0025 0.0118 0.0017
Plasmodium falciparum plasmepsin X 0.0077 0.0642 0.1639
Trichomonas vaginalis Clan AA, family A1, cathepsin D-like aspartic peptidase 0.0077 0.0642 0.1639
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0077 0.0642 0.0598
Plasmodium falciparum glutamyl-tRNA(Gln) amidotransferase subunit A 0.0025 0.0111 0.0179
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0083 0.0711 0.1829
Mycobacterium tuberculosis Probable amidase AmiB2 (aminohydrolase) 0.0025 0.0111 0.0179
Treponema pallidum aspartyl/glutamyl-tRNA amidotransferase subunit A 0.0025 0.0111 1
Mycobacterium ulcerans enoyl-(acyl carrier protein) reductase 0.0374 0.368 1
Echinococcus granulosus tar DNA binding protein 0.0062 0.0493 0.0993
Mycobacterium ulcerans 3-oxoacyl-ACP reductase 0.0025 0.0118 0.0196
Loa Loa (eye worm) amidase 0.0025 0.0111 0.0404
Brugia malayi aspartic protease BmAsp-1, identical 0.0077 0.0642 0.2329
Leishmania major pteridine reductase 1 0.0025 0.0118 1
Loa Loa (eye worm) hypothetical protein 0.0077 0.0642 0.2329
Mycobacterium ulcerans short chain dehydrogenase 0.0025 0.0118 0.0196
Plasmodium vivax plasmepsin V, putative 0.0077 0.0642 0.1639
Loa Loa (eye worm) hypothetical protein 0.0205 0.1953 0.7087
Schistosoma mansoni kinesin eg-5 0.0052 0.0387 0.0342
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0025 0.0118 0.0196
Schistosoma mansoni cathepsin D (A01 family) 0.0077 0.0642 0.0598
Mycobacterium ulcerans 3-ketoacyl-ACP reductase 0.0025 0.0118 0.0196
Plasmodium falciparum plasmepsin VI 0.0077 0.0642 0.1639
Schistosoma mansoni tar DNA-binding protein 0.0062 0.0493 0.0449
Mycobacterium ulcerans 3-ketoacyl-ACP reductase 0.0025 0.0118 0.0196
Mycobacterium ulcerans short chain dehydrogenase 0.0025 0.0118 0.0196
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0077 0.0642 0.0598
Plasmodium falciparum plasmepsin IV 0.0077 0.0642 0.1639
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0018 0.0046 0.0168
Plasmodium vivax aspartyl protease, putative 0.0077 0.0642 0.1639
Plasmodium falciparum plasmepsin VIII, putative 0.0077 0.0642 0.1639
Trypanosoma cruzi oxidoreductase-like protein, putative 0.0025 0.0118 1
Plasmodium vivax aspartyl proteinase, putative 0.0077 0.0642 0.1639
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0062 0.0493 0.1789
Mycobacterium leprae 3-OXOACYL-[ACYL-CARRIER PROTEIN] REDUCTASE FABG1 (3-KETOACYL-ACYL CARRIER PROTEIN REDUCTASE) (MYCOLIC ACID BIOSYNTHESIS A PROTEI 0.0025 0.0118 0.0017
Echinococcus granulosus fatty acid amide hydrolase 1 0.0205 0.1953 0.3934
Loa Loa (eye worm) TAR-binding protein 0.0062 0.0493 0.1789
Mycobacterium tuberculosis Possible 20-beta-hydroxysteroid dehydrogenase FabG3 (cortisone reductase) ((R)-20-hydroxysteroid dehydrogenase) 0.0025 0.0118 0.0196
Mycobacterium tuberculosis Probable glutamine-binding lipoprotein GlnH (GLNBP) 0.0019 0.0054 0.002
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0025 0.0118 0.0196
Plasmodium falciparum 3-oxoacyl-[acyl-carrier-protein] reductase 0.0025 0.0118 0.0196
Echinococcus multilocularis nmda type glutamate receptor 0.0027 0.0129 0.026
Plasmodium vivax aspartyl protease, putative 0.0077 0.0642 0.1639
Mycobacterium leprae NADH-DEPENDENT ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE INHA (NADH-DEPENDENT ENOYL-ACP REDUCTASE) 0.0374 0.368 1

Activities

Activity type Activity value Assay description Source Reference
GI50 (functional) -4 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 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 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 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 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 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 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
GI50 (functional) -4 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 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SF-539 Central Nervous System cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 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 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

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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