Detailed information for compound 1424946

Basic information

Technical information
  • TDR Targets ID: 1424946
  • Name: 1-(2-methyl-2,3-dihydroindol-1-yl)-3-(3-methy lpyrazol-1-yl)propan-1-one
  • MW: 269.342 | Formula: C16H19N3O
  • H donors: 0 H acceptors: 2 LogP: 2.02 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC1Cc2c(N1C(=O)CCn1ccc(n1)C)cccc2
  • InChi: 1S/C16H19N3O/c1-12-7-9-18(17-12)10-8-16(20)19-13(2)11-14-5-3-4-6-15(14)19/h3-7,9,13H,8,10-11H2,1-2H3
  • InChiKey: NYLFOEQMLDJFBN-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 1-(2-methylindolin-1-yl)-3-(3-methylpyrazol-1-yl)propan-1-one
  • 1-(2-methyl-1-indolinyl)-3-(3-methyl-1-pyrazolyl)propan-1-one

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
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0353 0.0785 0.0785
Loa Loa (eye worm) hypothetical protein 0.0166 0.0326 0.0326
Echinococcus multilocularis ecdysone induced protein 78C 0.0353 0.0785 0.0785
Loa Loa (eye worm) hypothetical protein 0.0338 0.0749 0.0749
Loa Loa (eye worm) hypothetical protein 0.0186 0.0376 0.0376
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0338 0.0749 1
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.0024 0.0351
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0213 0.0442 0.0442
Trichomonas vaginalis CAMK family protein kinase 0.0312 0.0685 1
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0067 0.0083 0.0083
Schistosoma mansoni phosphatidylinositol-4-phosphate 5-kinase type II 0.018 0.0361 0.0378
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0067 0.0083 0.0083
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0312 0.0685 0.0685
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0186 0.0376 0.0376
Brugia malayi orphan nuclear receptor NR2E1 0.0166 0.0326 0.0326
Loa Loa (eye worm) hypothetical protein 0.0166 0.0326 0.0326
Echinococcus granulosus Nuclear hormone receptor HR96 0.0166 0.0326 0.0326
Brugia malayi latrophilin 2 splice variant baaae 0.0146 0.0276 0.0276
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.0166 0.0326 0.0326
Loa Loa (eye worm) hypothetical protein 0.0166 0.0326 0.0326
Giardia lamblia Kinase, PLK 0.0312 0.0685 0.5
Brugia malayi Steroid receptor seven-up type 2 0.0353 0.0785 0.0785
Loa Loa (eye worm) hypothetical protein 0.0353 0.0785 0.0785
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0353 0.0785 0.0785
Loa Loa (eye worm) hypothetical protein 0.0043 0.0024 0.0024
Loa Loa (eye worm) RNA binding protein 0.0065 0.0077 0.0077
Mycobacterium tuberculosis Probable lipase LipE 0.0043 0.0024 0.04
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0065 0.0077 0.0077
Onchocerca volvulus Protein ultraspiracle homolog 0.0353 0.0785 1
Schistosoma mansoni thyroid hormone receptor 0.0353 0.0785 0.0823
Trypanosoma cruzi polo-like protein kinase, putative 0.0312 0.0685 1
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0338 0.0749 0.5
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0353 0.0785 1
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0353 0.0785 0.0785
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0353 0.0785 0.0785
Trichomonas vaginalis CAMK family protein kinase 0.0154 0.0297 0.4132
Loa Loa (eye worm) hypothetical protein 0.018 0.0361 0.0361
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0312 0.0685 0.0685
Brugia malayi steroid hormone receptor 0.0353 0.0785 0.0785
Loa Loa (eye worm) hypothetical protein 0.0186 0.0376 0.0376
Echinococcus multilocularis GPCR, family 2 0.0067 0.0083 0.0083
Loa Loa (eye worm) hypothetical protein 0.0043 0.0024 0.0024
Loa Loa (eye worm) hypothetical protein 0.0166 0.0326 0.0326
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0077 0.0081
Schistosoma mansoni nuclear hormone receptor 0.0353 0.0785 0.0823
Brugia malayi RNA recognition motif domain containing protein 0.0065 0.0077 0.0077
Brugia malayi Probable ClpP-like protease 0.0338 0.0749 0.0749
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0353 0.0785 0.0785
Leishmania major hypothetical protein, conserved 0.0043 0.0024 0.0351
Loa Loa (eye worm) nuclear receptor NHR-67 0.0166 0.0326 0.0326
Loa Loa (eye worm) hypothetical protein 0.0146 0.0276 0.0276
Echinococcus granulosus phosphatidylinositol 5 phosphate 4 kinase type 2 0.018 0.0361 0.0361
Onchocerca volvulus Bile acid receptor homolog 0.0353 0.0785 1
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0353 0.0785 0.0785
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0116 0.0204 0.2719
Trichomonas vaginalis CAMK family protein kinase 0.0312 0.0685 1
Echinococcus multilocularis thyroid hormone receptor alpha 0.0353 0.0785 0.0785
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.4095 1 1
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0067 0.0083 0.0083
Schistosoma mansoni steroid hormone receptor ad4bp 0.0353 0.0785 0.0823
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0077 0.0081
Loa Loa (eye worm) hypothetical protein 0.0186 0.0376 0.0376
Echinococcus multilocularis peptidase Clp (S14 family) 0.0222 0.0462 0.0462
Loa Loa (eye worm) hypothetical protein 0.0187 0.0376 0.0376
Brugia malayi nuclear hormone receptor 0.0353 0.0785 0.0785
Loa Loa (eye worm) TAR-binding protein 0.0065 0.0077 0.0077
Loa Loa (eye worm) hypothetical protein 0.0166 0.0326 0.0326
Brugia malayi Nuclear hormone receptor E75 0.0166 0.0326 0.0326
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0353 0.0785 0.0823
Brugia malayi RNA binding protein 0.0065 0.0077 0.0077
Loa Loa (eye worm) hypothetical protein 0.0353 0.0785 0.0785
Loa Loa (eye worm) latrophilin receptor protein 2 0.0067 0.0083 0.0083
Echinococcus multilocularis phosphatidylinositol 5 phosphate 4 kinase type 2 0.018 0.0361 0.0361
Mycobacterium tuberculosis Probable esterase LipL 0.0043 0.0024 0.04
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0186 0.0376 0.0394
Loa Loa (eye worm) hypothetical protein 0.0213 0.0442 0.0442
Loa Loa (eye worm) hypothetical protein 0.0166 0.0326 0.0326
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.0166 0.0326 0.0326
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0077 0.0081
Schistosoma mansoni serine/threonine protein kinase 0.0312 0.0685 0.0718
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0077 0.0081
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0353 0.0785 0.0785
Trichomonas vaginalis CAMK family protein kinase 0.0312 0.0685 1
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0353 0.0785 0.0785
Loa Loa (eye worm) hypothetical protein 0.0166 0.0326 0.0326
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0043 0.0024 0.04
Trichomonas vaginalis CAMK family protein kinase 0.0312 0.0685 1
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0353 0.0785 0.0785
Loa Loa (eye worm) hypothetical protein 0.0353 0.0785 0.0785
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0166 0.0326 0.3974
Schistosoma mansoni retinoic acid receptor RXR 0.0353 0.0785 0.0823
Brugia malayi nuclear hormone receptor 0.0166 0.0326 0.0326
Brugia malayi Nuclear hormone receptor-like 1 0.0186 0.0376 0.0376
Brugia malayi beta-lactamase 0.0043 0.0024 0.0024
Brugia malayi nuclear receptor NHR-88 0.0353 0.0785 0.0785
Schistosoma mansoni hypothetical protein 0.0067 0.0083 0.0087
Mycobacterium leprae ATP-dependent Clp protease proteolytic subunit 1 0.0116 0.0204 0.2477
Loa Loa (eye worm) hypothetical protein 0.0353 0.0785 0.0785
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0353 0.0785 0.0785
Echinococcus granulosus Nuclear hormone receptor HR96 0.0166 0.0326 0.0326
Brugia malayi nuclear receptor RXR 0.0166 0.0326 0.0326
Schistosoma mansoni RAR-like nuclear receptor 0.0353 0.0785 0.0823
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0353 0.0785 0.0785
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0353 0.0785 0.0785
Loa Loa (eye worm) hypothetical protein 0.0166 0.0326 0.0326
Schistosoma mansoni zinc finger protein 0.0166 0.0326 0.0342
Echinococcus multilocularis beta LACTamase domain containing family member 0.0043 0.0024 0.0024
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0024 0.0025
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0166 0.0326 0.3974
Plasmodium vivax hypothetical protein, conserved 0.0043 0.0024 0.0321
Loa Loa (eye worm) hypothetical protein 0.0067 0.0083 0.0083
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0353 0.0785 0.0785
Loa Loa (eye worm) hypothetical protein 0.0043 0.0024 0.0024
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0338 0.0749 1
Loa Loa (eye worm) nuclear hormone receptor 0.0166 0.0326 0.0326
Trichomonas vaginalis CAMK family protein kinase 0.0312 0.0685 1
Mycobacterium tuberculosis Probable lipase LipD 0.0043 0.0024 0.04
Echinococcus granulosus thyroid hormone receptor alpha 0.0166 0.0326 0.0326
Loa Loa (eye worm) hypothetical protein 0.0353 0.0785 0.0785
Schistosoma mansoni kinase 0.0159 0.0307 0.0322
Toxoplasma gondii ABC1 family protein 0.0043 0.0024 0.0321
Brugia malayi serine/threonine-protein kinase plk-2 0.0312 0.0685 0.0685
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0338 0.0749 1
Loa Loa (eye worm) hypothetical protein 0.0166 0.0326 0.0326
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0353 0.0785 0.0823
Schistosoma mansoni hypothetical protein 0.0067 0.0083 0.0087
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0312 0.0685 1
Mycobacterium tuberculosis Probable hydrolase 0.0043 0.0024 0.04
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0353 0.0785 0.0823
Schistosoma mansoni phosphatidylinositol-4-phosphate 5-kinase type II 0.018 0.0361 0.0378
Loa Loa (eye worm) nuclear receptor nhr-7B 0.0166 0.0326 0.0326
Loa Loa (eye worm) hypothetical protein 0.0353 0.0785 0.0785
Loa Loa (eye worm) beta-lactamase 0.0043 0.0024 0.0024
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0166 0.0326 0.0326
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0338 0.0749 0.5
Brugia malayi nuclear hormone receptor family member nhr-6 0.0166 0.0326 0.0326
Brugia malayi ecdysone receptor 0.0166 0.0326 0.0326
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0043 0.0024 0.0024
Onchocerca volvulus 0.0353 0.0785 1
Loa Loa (eye worm) hypothetical protein 0.0186 0.0376 0.0376
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0353 0.0785 0.0785
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0077 0.0081
Trichomonas vaginalis CAMK family protein kinase 0.0312 0.0685 1
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0067 0.0083 0.0083
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.3909 0.9541 1
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0353 0.0785 0.0823
Echinococcus multilocularis FTZ F1 alpha 0.0353 0.0785 0.0785
Trypanosoma cruzi polo-like protein kinase, putative 0.0312 0.0685 1
Brugia malayi beta-lactamase family protein 0.0043 0.0024 0.0024
Loa Loa (eye worm) hypothetical protein 0.0043 0.0024 0.0024
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0338 0.0749 1
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0338 0.0749 0.0749
Loa Loa (eye worm) steroid hormone receptor 0.0353 0.0785 0.0785
Schistosoma mansoni nuclear receptor nhr-48 0.0166 0.0326 0.0342
Echinococcus granulosus GPCR family 2 0.0067 0.0083 0.0083
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0353 0.0785 0.0785
Brugia malayi hypothetical protein 0.0166 0.0326 0.0326
Echinococcus granulosus beta LACTamase domain containing family member 0.0043 0.0024 0.0024
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0338 0.0749 0.0749
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0116 0.0204 0.2719
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0024 0.0025
Brugia malayi N-terminal motif family protein 0.0187 0.0376 0.0376
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0353 0.0785 0.0785
Schistosoma mansoni hypothetical protein 0.0067 0.0083 0.0087
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0353 0.0785 0.0785
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0353 0.0785 0.0823
Brugia malayi Nuclear hormone receptor E75 0.0166 0.0326 0.0326
Onchocerca volvulus Serine\/threonine kinase homolog 0.0312 0.0685 0.8682
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.0166 0.0326 0.0326
Brugia malayi Latrophilin receptor protein 2 0.0067 0.0083 0.0083
Loa Loa (eye worm) pip kinase 2 0.018 0.0361 0.0361
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0312 0.0685 0.0685
Loa Loa (eye worm) hypothetical protein 0.0166 0.0326 0.0326
Brugia malayi Nuclear hormone receptor-like 1 0.0353 0.0785 0.0785
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0043 0.0024 0.04
Onchocerca volvulus 0.0166 0.0326 0.3974
Echinococcus granulosus nuclear receptor nhr 48 0.0166 0.0326 0.0326
Brugia malayi photoreceptor-specific nuclear receptor 0.0353 0.0785 0.0785
Brugia malayi hypothetical protein 0.0166 0.0326 0.0326
Toxoplasma gondii hypothetical protein 0.0116 0.0204 0.2719
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0353 0.0785 0.0785
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0353 0.0785 0.0785
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0353 0.0785 0.0785
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0043 0.0024 0.04
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0353 0.0785 0.0785
Mycobacterium tuberculosis Conserved protein 0.0043 0.0024 0.04
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0213 0.0442 0.0442
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.4095 1 1
Schistosoma mansoni hypothetical protein 0.0146 0.0276 0.0289
Brugia malayi beta-lactamase family protein 0.0043 0.0024 0.0024
Mycobacterium tuberculosis Conserved protein 0.0043 0.0024 0.04
Brugia malayi Pip kinase protein 2 0.018 0.0361 0.0361
Brugia malayi nuclear receptor RXR 0.0186 0.0376 0.0376
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0278 0.0601 1
Schistosoma mansoni nuclear receptor 0.0166 0.0326 0.0342
Trypanosoma brucei hypothetical protein, conserved 0.0043 0.0024 0.0351
Schistosoma mansoni hypothetical protein 0.0067 0.0083 0.0087
Loa Loa (eye worm) hypothetical protein 0.0353 0.0785 0.0785
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0166 0.0326 0.0326
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0353 0.0785 0.0785
Brugia malayi hypothetical protein 0.0186 0.0376 0.0376
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog 0.0187 0.0376 0.4629
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.0222 0.0462 0.7695
Schistosoma mansoni peptidase Clp (S14 family) 0.0338 0.0749 0.0785
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0353 0.0785 0.0785
Brugia malayi hypothetical protein 0.0186 0.0376 0.0376
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0166 0.0326 0.0326
Loa Loa (eye worm) hypothetical protein 0.0043 0.0024 0.0024
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.0222 0.0462 0.6046
Echinococcus granulosus FTZ F1 alpha 0.0353 0.0785 0.0785
Loa Loa (eye worm) DR-78 0.0166 0.0326 0.0326
Brugia malayi Calcitonin receptor-like protein seb-1 0.0213 0.0442 0.0442
Schistosoma mansoni nuclear receptor 0.0166 0.0326 0.0342
Loa Loa (eye worm) hypothetical protein 0.0043 0.0024 0.0024
Schistosoma mansoni thyroid hormone receptor 0.0353 0.0785 0.0823
Onchocerca volvulus 0.0166 0.0326 0.3974
Echinococcus multilocularis tar DNA binding protein 0.0065 0.0077 0.0077
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.0024 0.0351
Brugia malayi conserved hypotetical protein 0.0166 0.0326 0.0326
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0186 0.0376 0.0394
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.4095 1 1
Brugia malayi nuclear receptor NHR-67 0.0166 0.0326 0.0326
Brugia malayi ecdysteroid receptor 0.0353 0.0785 0.0785
Brugia malayi nuclear receptor NHR-88 0.0166 0.0326 0.0326
Entamoeba histolytica serine/threonine protein kinase, putative 0.0312 0.0685 0.5
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.0166 0.0326 0.0326
Brugia malayi nuclear hormone receptor family member odr-7 0.0166 0.0326 0.0326
Echinococcus multilocularis nuclear receptor nhr 48 0.0166 0.0326 0.0326
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0166 0.0326 0.0342
Brugia malayi Nuclear hormone receptor-like 1 0.0186 0.0376 0.0376
Loa Loa (eye worm) hypothetical protein 0.0186 0.0376 0.0376
Schistosoma mansoni coup transcription factor 0.0353 0.0785 0.0823
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0353 0.0785 0.0785
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0338 0.0749 1
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0338 0.0749 1
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0186 0.0376 0.0376
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0338 0.0749 1
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0067 0.0083 0.0083
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.0222 0.0462 0.7695
Mycobacterium tuberculosis Conserved protein 0.0043 0.0024 0.04
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0353 0.0785 0.0785
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0186 0.0376 0.0376
Echinococcus granulosus ecdysone induced protein 78C 0.0353 0.0785 0.0785
Loa Loa (eye worm) hypothetical protein 0.0166 0.0326 0.0326
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0166 0.0326 0.0326
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0043 0.0024 0.0024
Trichomonas vaginalis CAMK family protein kinase 0.0312 0.0685 1
Trypanosoma brucei polo-like protein kinase 0.0312 0.0685 1
Echinococcus granulosus peptidase Clp S14 family 0.0222 0.0462 0.0462
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0353 0.0785 0.0785
Trichomonas vaginalis CAMK family protein kinase 0.0154 0.0297 0.4132
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0353 0.0785 0.0785
Echinococcus granulosus tar DNA binding protein 0.0065 0.0077 0.0077
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0338 0.0749 0.5
Schistosoma mansoni nuclear hormone receptor 0.0166 0.0326 0.0342
Onchocerca volvulus 0.018 0.0361 0.4422
Schistosoma mansoni nuclear hormone receptor 0.0166 0.0326 0.0342
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0353 0.0785 0.0785
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0353 0.0785 0.0823
Loa Loa (eye worm) hypothetical protein 0.0353 0.0785 0.0785
Loa Loa (eye worm) hypothetical protein 0.0166 0.0326 0.0326
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0338 0.0749 1
Loa Loa (eye worm) hypothetical protein 0.0166 0.0326 0.0326
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0353 0.0785 0.0785
Brugia malayi TAR-binding protein 0.0065 0.0077 0.0077
Brugia malayi tailless protein 0.0166 0.0326 0.0326

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 5.0119 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) 50.1187 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Kappa. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588638] 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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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