Detailed information for compound 1281696

Basic information

Technical information
  • TDR Targets ID: 1281696
  • Name: NCGC00101455-01
  • MW: 446.5 | Formula: C28H22N4O2
  • H donors: 0 H acceptors: 3 LogP: 5.43 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1ccc(cc1)c1nc2ccccc2n2c1c1n(C)c(=O)n(c(=O)c1c2c1ccccc1)C
  • InChi: 1S/C28H22N4O2/c1-17-13-15-18(16-14-17)23-26-25-22(27(33)31(3)28(34)30(25)2)24(19-9-5-4-6-10-19)32(26)21-12-8-7-11-20(21)29-23/h4-16H,1-3H3
  • InChiKey: GZYFRHANVHFRKU-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Escherichia coli penicillin-binding protein Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Mycobacterium tuberculosis Possible penicillin-binding protein Get druggable targets OG5_149948 All targets in OG5_149948
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
Mycobacterium tuberculosis Probable bacterioferritin BfrA 0.0008 0.0109 0.0009
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0006 0.006 0.0606
Schistosoma mansoni retinoid-x-receptor (RXR) 0.001 0.0149 0.0148
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0149 0.0144
Schistosoma mansoni ferritin 0.0008 0.0109 0.0108
Loa Loa (eye worm) hypothetical protein 0.0005 0.0028 0.0011
Trichomonas vaginalis penicillin-binding protein, putative 0.0043 0.0996 1
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0005 0.0028 0.001
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0043 0.0996 0.1313
Echinococcus multilocularis ATP binding cassette sub family G 0.001 0.0143 0.0126
Loa Loa (eye worm) ABC transporter 0.0008 0.0106 0.0097
Treponema pallidum bacterioferrin (TpF1) 0.0008 0.0109 0.5
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0006 0.006 0.0606
Trichomonas vaginalis conserved hypothetical protein 0.0006 0.006 0.0606
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0996 0.0995
Brugia malayi Nuclear hormone receptor family member nhr-31 0.001 0.0149 0.0144
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.001 0.0149 0.1347
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.001 0.0149 0.0144
Toxoplasma gondii histone lysine methyltransferase SET1 0.0057 0.1331 0.132
Schistosoma mansoni DNA topoisomerase type I 0.0275 0.6824 0.6823
Brugia malayi Nuclear hormone receptor family member nhr-14 0.001 0.0149 0.0144
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0149 0.0132
Schistosoma mansoni DNA topoisomerase type I 0.0275 0.6824 0.6823
Schistosoma mansoni bromodomain containing protein 0.0005 0.0028 0.0026
Brugia malayi CXXC zinc finger family protein 0.0028 0.0609 0.0648
Entamoeba histolytica acetyltransferase, GNAT family 0.0038 0.0864 1
Schistosoma mansoni ferritin 0.0008 0.0109 0.0108
Brugia malayi F/Y-rich N-terminus family protein 0.0009 0.0116 0.0108
Mycobacterium tuberculosis Probable lipase LipE 0.0043 0.0996 0.1313
Schistosoma mansoni cpg binding protein 0.003 0.0649 0.0648
Brugia malayi nuclear receptor NHR-88 0.001 0.0149 0.0144
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0009 0.0119 0.0102
Brugia malayi Nuclear hormone receptor family member nhr-3 0.001 0.0149 0.0144
Trypanosoma brucei DNA topoisomerase IB, large subunit 0.0275 0.6824 1
Brugia malayi nuclear receptor RXR 0.0005 0.0031 0.0015
Schistosoma mansoni apoferritin-2 0.0008 0.0109 0.0108
Brugia malayi ecdysteroid receptor 0.001 0.0149 0.0144
Toxoplasma gondii ABC1 family protein 0.0043 0.0996 0.0947
Schistosoma mansoni thyroid hormone receptor 0.001 0.0149 0.0148
Schistosoma mansoni ABC transporter 0.0008 0.0106 0.0104
Echinococcus multilocularis ferritin 0.0008 0.0109 0.0092
Loa Loa (eye worm) steroid hormone receptor 0.001 0.0149 0.0144
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0149 0.0132
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.001 0.0149 0.0144
Loa Loa (eye worm) hypothetical protein 0.0005 0.0031 0.0015
Echinococcus granulosus ATP binding cassette sub family G 0.001 0.0143 0.0126
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0278 0.6903 1
Loa Loa (eye worm) hypothetical protein 0.001 0.0149 0.0144
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.001 0.0149 0.0132
Mycobacterium leprae Probable lipase LipE 0.0043 0.0996 1
Loa Loa (eye worm) hypothetical protein 0.001 0.0149 0.0144
Brugia malayi nuclear hormone receptor 0.001 0.0149 0.0144
Schistosoma mansoni steroid hormone receptor ad4bp 0.001 0.0149 0.0148
Schistosoma mansoni RAR-like nuclear receptor 0.001 0.0149 0.0148
Echinococcus granulosus ATP binding cassette sub family G 0.001 0.0143 0.0126
Echinococcus multilocularis beta LACTamase domain containing family member 0.0043 0.0996 0.098
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0042 0.0952 0.0899
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.0996 0.1277
Trichomonas vaginalis conserved hypothetical protein 0.0006 0.006 0.0606
Echinococcus granulosus cpg binding protein 0.003 0.0649 0.0633
Mycobacterium ulcerans lipase LipD 0.0043 0.0996 1
Wolbachia endosymbiont of Brugia malayi bacterioferritin/cytochrome b1 0.0008 0.0109 0.5
Loa Loa (eye worm) hypothetical protein 0.0043 0.0996 0.1072
Echinococcus multilocularis thyroid hormone receptor alpha 0.001 0.0149 0.0132
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.001 0.0149 0.0148
Loa Loa (eye worm) hypothetical protein 0.001 0.0149 0.0144
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.001 0.0149 0.0132
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0042 0.0952 0.1038
Brugia malayi Nuclear hormone receptor-like 1 0.001 0.0149 0.0144
Plasmodium vivax topoisomerase I, putative 0.0367 0.9148 1
Trichomonas vaginalis conserved hypothetical protein 0.0006 0.006 0.0606
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0149 0.0144
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0149 0.0144
Brugia malayi hypothetical protein 0.0005 0.0031 0.0015
Echinococcus granulosus mixed lineage leukemia protein mll 0.0007 0.0076 0.0059
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0142 0.3479 0.3467
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0149 0.0132
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0005 0.0017 0.0016
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.0996 0.1277
Echinococcus granulosus ferritin 0.0008 0.0109 0.0092
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0005 0.0031 0.003
Echinococcus granulosus retinoic acid receptor rxr beta a 0.001 0.0149 0.0132
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.001 0.0143 0.038
Plasmodium falciparum histone acetyltransferase GCN5 0.0038 0.0864 0.0802
Trichomonas vaginalis conserved hypothetical protein 0.0006 0.006 0.0606
Trichomonas vaginalis conserved hypothetical protein 0.0006 0.006 0.0606
Echinococcus granulosus zinc finger protein 0.0005 0.0028 0.001
Schistosoma mansoni thyroid hormone receptor 0.001 0.0149 0.0148
Mycobacterium tuberculosis Probable hydrolase 0.0043 0.0996 0.1313
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0005 0.0028 0.001
Trichomonas vaginalis conserved hypothetical protein 0.0006 0.006 0.0606
Mycobacterium tuberculosis Probable esterase LipL 0.0043 0.0996 0.1313
Schistosoma mansoni ferritin 0.0008 0.0109 0.0108
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0996 1
Leishmania major hypothetical protein, conserved 0.0043 0.0996 0.1277
Echinococcus multilocularis ATP binding cassette sub family G 0.001 0.0143 0.0126
Mycobacterium tuberculosis Conserved protein 0.0043 0.0996 0.1313
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0996 1
Schistosoma mansoni nuclear receptor 0.0005 0.0017 0.0016
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.001 0.0149 0.0132
Leishmania major DNA topoisomerase IB, large subunit 0.0275 0.6824 1
Schistosoma mansoni ATP-binding cassette sub-family g2 (white protein) (abcg2) 0.001 0.0143 0.0141
Loa Loa (eye worm) hypothetical protein 0.0043 0.0996 0.1072
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.001 0.0149 0.0144
Mycobacterium tuberculosis Probable lipase LipD 0.0043 0.0996 0.1313
Schistosoma mansoni coup transcription factor 0.001 0.0149 0.0148
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0007 0.0076 0.0059
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.001 0.0149 0.0144
Trichomonas vaginalis ferritin, putative 0.0008 0.0109 0.1094
Loa Loa (eye worm) CXXC zinc finger family protein 0.0028 0.0609 0.0648
Mycobacterium leprae conserved hypothetical protein 0.0043 0.0996 1
Loa Loa (eye worm) histone methyltransferase 0.0009 0.0119 0.0111
Loa Loa (eye worm) hypothetical protein 0.001 0.0149 0.0144
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0149 0.0144
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.001 0.0143 0.038
Onchocerca volvulus 0.0043 0.0996 1
Schistosoma mansoni ferritin 0.0008 0.0109 0.0108
Echinococcus multilocularis FTZ F1 alpha 0.001 0.0149 0.0132
Brugia malayi steroid hormone receptor 0.001 0.0149 0.0144
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0005 0.0031 0.0014
Trichomonas vaginalis bromodomain-containing protein, putative 0.0042 0.0952 0.9561
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0006 0.006 0.0606
Schistosoma mansoni nuclear receptor 0.0005 0.0017 0.0016
Brugia malayi Nuclear hormone receptor-like 1 0.0005 0.0031 0.0015
Loa Loa (eye worm) hypothetical protein 0.0005 0.0031 0.0015
Loa Loa (eye worm) hypothetical protein 0.001 0.0149 0.0144
Giardia lamblia Histone acetyltransferase GCN5 0.0038 0.0864 1
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0009 0.0119 0.0102
Onchocerca volvulus Bile acid receptor homolog 0.001 0.0149 0.1347
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0996 0.0995
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0043 0.0996 1
Schistosoma mansoni apoferritin-2 0.0008 0.0109 0.0108
Echinococcus granulosus expressed protein 0.0008 0.0109 0.0092
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0042 0.0952 0.9561
Onchocerca volvulus 0.001 0.0149 0.1347
Brugia malayi Nuclear hormone receptor family member nhr-40 0.001 0.0149 0.0144
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.001 0.0149 0.0144
Schistosoma mansoni nuclear receptor nhr-48 0.0005 0.0017 0.0016
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0005 0.0017 0.0016
Echinococcus granulosus histone acetyltransferase KAT2B 0.0042 0.0952 0.0936
Trichomonas vaginalis penicillin-binding protein, putative 0.0043 0.0996 1
Schistosoma mansoni nuclear hormone receptor 0.0005 0.0017 0.0016
Schistosoma mansoni nuclear hormone receptor 0.0005 0.0017 0.0016
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0149 0.0144
Brugia malayi hypothetical protein 0.0005 0.0031 0.0015
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0007 0.0076 0.0059
Brugia malayi Nuclear hormone receptor family member nhr-41 0.001 0.0149 0.0144
Echinococcus granulosus ATP binding cassette sub family G 0.001 0.0143 0.0126
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0043 0.0996 0.1072
Echinococcus multilocularis DNA topoisomerase 1 0.0367 0.9148 0.9146
Schistosoma mansoni zinc finger protein 0.0005 0.0028 0.0026
Onchocerca volvulus Protein ultraspiracle homolog 0.001 0.0149 0.1347
Echinococcus multilocularis ecdysone induced protein 78C 0.001 0.0149 0.0132
Echinococcus multilocularis expressed protein 0.0008 0.0109 0.0092
Schistosoma mansoni nuclear hormone receptor 0.001 0.0149 0.0148
Schistosoma mansoni zinc finger protein 0.0005 0.0017 0.0016
Brugia malayi Steroid receptor seven-up type 2 0.001 0.0149 0.0144
Onchocerca volvulus 0.0043 0.0996 1
Echinococcus multilocularis ATP binding cassette sub family G 0.001 0.0143 0.0126
Mycobacterium tuberculosis Conserved protein 0.0043 0.0996 0.1313
Trichomonas vaginalis conserved hypothetical protein 0.0006 0.006 0.0606
Loa Loa (eye worm) beta-lactamase 0.0043 0.0996 0.1072
Brugia malayi beta-lactamase family protein 0.0043 0.0996 0.1072
Mycobacterium ulcerans esterase/lipase LipP 0.0043 0.0996 1
Brugia malayi Bromodomain containing protein 0.0005 0.0028 0.0011
Loa Loa (eye worm) acetyltransferase 0.0142 0.3479 0.3791
Schistosoma mansoni Tr4/Tr2 (homologue) 0.001 0.0149 0.0148
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0006 0.006 0.0606
Mycobacterium tuberculosis Conserved protein 0.0043 0.0996 0.1313
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.001 0.0143 0.038
Leishmania major DNA topoisomerase type IB small subunit 0.0092 0.2223 0.3114
Loa Loa (eye worm) hypothetical protein 0.0043 0.0996 0.1072
Brugia malayi beta-lactamase 0.0043 0.0996 0.1072
Echinococcus multilocularis dnaJ subfamily B 0.0401 1 1
Brugia malayi Nuclear hormone receptor family member nhr-49 0.001 0.0149 0.0144
Loa Loa (eye worm) hypothetical protein 0.0005 0.0031 0.0015
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0043 0.0996 0.1313
Trypanosoma cruzi DNA topoisomerase type IB small subunit, putative 0.0092 0.2223 0.3114
Echinococcus granulosus histone acetyltransferase KAT2B 0.0138 0.3378 0.3367
Trichomonas vaginalis conserved hypothetical protein 0.0006 0.006 0.0606
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0149 0.0132
Plasmodium vivax hypothetical protein, conserved 0.0043 0.0996 0.1086
Loa Loa (eye worm) hypothetical protein 0.0043 0.0996 0.1072
Echinococcus multilocularis zinc finger protein 0.0005 0.0028 0.001
Mycobacterium ulcerans beta-lactamase 0.0043 0.0996 1
Brugia malayi acetyltransferase, GNAT family protein 0.0142 0.3479 0.3791
Echinococcus granulosus FTZ F1 alpha 0.001 0.0149 0.0132
Schistosoma mansoni cpg binding protein 0.0028 0.0609 0.0608
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.001 0.0149 0.0148
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0996 1
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0042 0.0952 0.0899
Brugia malayi Nuclear hormone receptor-like 1 0.0005 0.0031 0.0015
Echinococcus granulosus DNA topoisomerase 1 0.0367 0.9148 0.9146
Trypanosoma brucei hypothetical protein, conserved 0.0043 0.0996 0.1277
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0007 0.0076 0.0074
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.001 0.0149 0.0132
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.001 0.0149 0.0148
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0142 0.3479 0.3478
Loa Loa (eye worm) hypothetical protein 0.0005 0.0031 0.0015
Mycobacterium tuberculosis Bacterioferritin BfrB 0.0008 0.0109 0.0009
Schistosoma mansoni mixed-lineage leukemia protein mll 0.006 0.1404 0.1403
Brugia malayi photoreceptor-specific nuclear receptor 0.001 0.0149 0.0144
Echinococcus granulosus ecdysone induced protein 78C 0.001 0.0149 0.0132
Loa Loa (eye worm) hypothetical protein 0.0043 0.0996 0.1072
Trichomonas vaginalis helicase, putative 0.0006 0.006 0.0606
Loa Loa (eye worm) hypothetical protein 0.0005 0.0028 0.0011
Brugia malayi ABC transporter family protein 0.0008 0.0106 0.0097
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0007 0.0076 0.0059
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0149 0.0144
Loa Loa (eye worm) hypothetical protein 0.0005 0.0031 0.0015
Schistosoma mansoni ferritin light chain 0.0008 0.0109 0.0108
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0006 0.006 0.0606
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0006 0.006 0.0606
Schistosoma mansoni ferritin light chain 0.0008 0.0109 0.0108
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.001 0.0149 0.0144
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.001 0.0149 0.0132
Loa Loa (eye worm) hypothetical protein 0.001 0.0149 0.0144
Plasmodium vivax ABC transporter G family member 2, putative 0.001 0.0143 0.0153
Toxoplasma gondii DNA topoisomerase I, putative 0.0367 0.9148 1
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0006 0.006 0.0606
Trichomonas vaginalis esterase, putative 0.0043 0.0996 1
Schistosoma mansoni hypothetical protein 0.0401 1 1
Plasmodium falciparum topoisomerase I 0.0367 0.9148 1
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0005 0.0031 0.0014
Loa Loa (eye worm) hypothetical protein 0.001 0.0149 0.0144
Schistosoma mansoni retinoic acid receptor RXR 0.001 0.0149 0.0148
Trichomonas vaginalis conserved hypothetical protein 0.0006 0.006 0.0606
Loa Loa (eye worm) hypothetical protein 0.001 0.0149 0.0144
Schistosoma mansoni DNA topoisomerase type I 0.0367 0.9148 0.9147
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0005 0.0031 0.0015
Schistosoma mansoni bromodomain containing protein 0.0005 0.0028 0.0026
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.001 0.0149 0.0144
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.001 0.0149 0.0132
Trypanosoma cruzi DNA topoisomerase IB, large subunit, putative 0.0275 0.6824 1
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0006 0.006 0.0606
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.001 0.0149 0.0132
Echinococcus multilocularis cpg binding protein 0.003 0.0649 0.0633
Mycobacterium ulcerans hypothetical protein 0.0043 0.0996 1
Brugia malayi DNA topoisomerase I 0.0367 0.9148 1
Loa Loa (eye worm) hypothetical protein 0.0043 0.0996 0.1072
Onchocerca volvulus 0.0043 0.0996 1
Brugia malayi PHD-finger family protein 0.0005 0.0028 0.0011
Brugia malayi Nuclear hormone receptor family member nhr-1 0.001 0.0149 0.0144
Schistosoma mansoni hypothetical protein 0.0008 0.0103 0.0102
Schistosoma mansoni cpg binding protein 0.003 0.0649 0.0648
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.001 0.0149 0.0148
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0043 0.0996 0.1072
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0043 0.0996 0.1313
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.001 0.0149 0.0132
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0005 0.0031 0.003
Brugia malayi beta-lactamase family protein 0.0043 0.0996 0.1072
Onchocerca volvulus 0.0028 0.0609 0.6044
Trypanosoma brucei DNA topoisomerase type IB small subunit 0.0092 0.2223 0.3114
Echinococcus granulosus beta LACTamase domain containing family member 0.0043 0.0996 0.098
Loa Loa (eye worm) DNA topoisomerase I 0.0367 0.9148 1

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 0.7943 um PUBCHEM_BIOASSAY: qHTS Inhibitors of AmpC Beta-Lactamase (assay with detergent). (Class of assay: confirmatory) [Related pubchem assays: 1002 (Confirmation Concentration-Response Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent)), 585 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay without detergent) - a screen old NIH MLSMR collection), 584 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay with detergent) - a screen of the old NIH MLSMR collection), 1003 (Confirmation Cuvette-Based Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent))] ChEMBL. No reference
Potency (functional) 35.4813 uM PubChem BioAssay. A Novel Cell-Based Assay to Identify Small Molecules for B -Galactocerebrosidase. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Mammalian Selenoprotein Thioredoxin Reductase 1 (TrxR1): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488771] ChEMBL. No reference
Potency (functional) 100 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] 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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