Detailed information for compound 1392464

Basic information

Technical information
  • TDR Targets ID: 1392464
  • Name: 1-diethylamino-3-phenylurea
  • MW: 207.272 | Formula: C11H17N3O
  • H donors: 2 H acceptors: 1 LogP: 1.89 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCN(NC(=O)Nc1ccccc1)CC
  • InChi: 1S/C11H17N3O/c1-3-14(4-2)13-11(15)12-10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3,(H2,12,13,15)
  • InChiKey: ADOCDMSSTUOPFA-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 1-diethylamino-3-phenyl-urea
  • 1,1-Diethyl-4-phenylsemicarbazide
  • 2,2-Diethyl-N-phenylhydrazinecarboxamide
  • ZINC00329176
  • BAS 02804144
  • MLS000711658
  • SMR000281425

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens l(3)mbt-like 1 (Drosophila) Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus granulosus endonuclease exonuclease phosphatase Get druggable targets OG5_130415 All targets in OG5_130415
Schistosoma japonicum Lethal(3)malignant brain tumor-like 3 protein, putative Get druggable targets OG5_130415 All targets in OG5_130415
Echinococcus multilocularis endonuclease exonuclease phosphatase Get druggable targets OG5_130415 All targets in OG5_130415
Schistosoma japonicum Lethal(3)malignant brain tumor-like 4 protein, putative Get druggable targets OG5_130415 All targets in OG5_130415
Schistosoma mansoni hypothetical protein Get druggable targets OG5_130415 All targets in OG5_130415
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
Brugia malayi cathepsin F-like cysteine proteinase 0.0045 0.0416 0.0417
Brugia malayi Papain family cysteine protease containing protein 0.0079 0.1476 0.1644
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0145 0.3558 1
Entamoeba histolytica cysteine protease, putative 0.0079 0.1476 0.4054
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0145 0.3558 1
Entamoeba histolytica cysteine protease, putative 0.0079 0.1476 0.4054
Echinococcus granulosus polycomb protein SCMH1 0.0058 0.0806 0.0869
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.01 0.2138 0.2411
Brugia malayi Papain family cysteine protease containing protein 0.0079 0.1476 0.1644
Echinococcus multilocularis cathepsin L cysteine protease 0.0145 0.3558 0.4056
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0145 0.3558 1
Loa Loa (eye worm) hypothetical protein 0.01 0.2138 0.246
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0037 0.0153 0.0112
Loa Loa (eye worm) ctsf protein 0.0145 0.3558 0.4094
Trypanosoma cruzi cruzipain precursor, putative 0.0145 0.3558 0.4056
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0145 0.3558 1
Schistosoma mansoni SmCB2 peptidase (C01 family) 0.0309 0.8691 0.8684
Brugia malayi Cathepsin L-like precursor 0.0045 0.0416 0.0417
Brugia malayi cathepsin B-like cysteine proteinase 0.0309 0.8691 1
Onchocerca volvulus Cathepsin L homolog 0.0145 0.3558 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0145 0.3558 1
Entamoeba histolytica cysteine protease, putative 0.0079 0.1476 0.4054
Echinococcus granulosus cathepsin L cysteine proteinase 0.0145 0.3558 0.4056
Brugia malayi Papain family cysteine protease containing protein 0.0145 0.3558 0.4056
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0309 0.8691 0.8684
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0037 0.0153 0.0112
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0145 0.3558 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0145 0.3558 1
Echinococcus granulosus SAM and MBT domain containing protein 0.0058 0.0806 0.0869
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0145 0.3558 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0145 0.3558 1
Echinococcus multilocularis cathepsin L 0.0079 0.1476 0.1644
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0145 0.3558 1
Toxoplasma gondii cathepsin CPL 0.0145 0.3558 1
Trypanosoma cruzi cruzipain precursor, putative 0.0045 0.0416 0.0417
Entamoeba histolytica cysteine protease, putative 0.0079 0.1476 0.4054
Onchocerca volvulus 0.0145 0.3558 1
Brugia malayi mbt repeat family protein 0.0058 0.0806 0.0869
Echinococcus multilocularis cysteine protease 0.0145 0.3558 0.4056
Entamoeba histolytica cysteine proteinase, putative 0.0079 0.1476 0.4054
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0145 0.3558 1
Echinococcus multilocularis cathepsin b 0.0309 0.8691 1
Plasmodium falciparum cysteine proteinase falcipain 2b 0.0145 0.3558 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0145 0.3558 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0145 0.3558 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0145 0.3558 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0145 0.3558 1
Loa Loa (eye worm) MBCTL1 0.0066 0.1057 0.1216
Echinococcus multilocularis cysteine protease 0.0145 0.3558 0.4056
Plasmodium falciparum cysteine proteinase falcipain 1 0.0079 0.1476 0.4054
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.0037 0.0153 0.0112
Schistosoma mansoni cathepsin F (C01 family) 0.01 0.2138 0.2094
Loa Loa (eye worm) mbt repeat family protein 0.0058 0.0806 0.0927
Entamoeba histolytica cysteine proteinase, putative 0.0079 0.1476 0.4054
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0079 0.1476 0.1428
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0145 0.3558 1
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0145 0.3558 0.4056
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0145 0.3558 1
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0227 0.6129 0.7033
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0145 0.3558 1
Loa Loa (eye worm) hypothetical protein 0.01 0.2138 0.246
Entamoeba histolytica cysteine proteinase 1, putative 0.0079 0.1476 0.4054
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0145 0.3558 1
Plasmodium vivax unspecified product 0.0045 0.0416 0.1028
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0034 0.0077 0.006
Brugia malayi mbt repeat family protein 0.0058 0.0806 0.0869
Trypanosoma cruzi cysteine peptidase, putative 0.0145 0.3558 0.4056
Leishmania major cathepsin L-like protease 0.0145 0.3558 1
Leishmania major cathepsin L-like protease 0.0145 0.3558 1
Schistosoma mansoni voltage-gated potassium channel 0.004 0.0259 0.0205
Loa Loa (eye worm) hypothetical protein 0.0045 0.0416 0.0478
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0066 0.1057 0.1159
Entamoeba histolytica cysteine protease, putative 0.0145 0.3558 1
Echinococcus multilocularis SAM and MBT domain containing protein 0.0058 0.0806 0.0869
Leishmania major cathepsin L-like protease 0.0145 0.3558 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0145 0.3558 1
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.0037 0.0153 0.0176
Loa Loa (eye worm) hypothetical protein 0.0034 0.0056 0.0064
Trypanosoma cruzi cysteine peptidase, putative 0.0079 0.1476 0.1644
Loa Loa (eye worm) cysteine proteinase cathepsin Z 0.0034 0.0056 0.0064
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0045 0.0416 0.0478
Loa Loa (eye worm) hypothetical protein 0.0034 0.0056 0.0064
Schistosoma mansoni voltage-gated potassium channel 0.004 0.0259 0.0205
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0145 0.3558 1
Loa Loa (eye worm) hypothetical protein 0.0145 0.3558 0.4094
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.0119 0.2727 0.7626
Loa Loa (eye worm) hypothetical protein 0.0058 0.0806 0.0927
Loa Loa (eye worm) hypothetical protein 0.0034 0.0056 0.0064
Echinococcus granulosus cathepsin L 0.0079 0.1476 0.1644
Echinococcus granulosus histone acetyltransferase MYST2 0.0066 0.1057 0.1159
Trypanosoma cruzi cysteine proteinase, putative 0.0079 0.1476 0.1644
Onchocerca volvulus Cathepsin L homolog 0.0145 0.3558 1
Brugia malayi Cathepsin L-like cysteine proteinase 0.01 0.2138 0.2411
Entamoeba histolytica cysteine proteinase, putative 0.0145 0.3558 1
Brugia malayi Cathepsin L-like precursor 0.0145 0.3558 0.4056
Loa Loa (eye worm) hypothetical protein 0.0045 0.0416 0.0478
Schistosoma mansoni myelin transcription factor 1 myt1 0.0066 0.1057 0.1007
Brugia malayi Cathepsin L-like precursor 0.0145 0.3558 0.4056
Loa Loa (eye worm) hypothetical protein 0.0309 0.8691 1
Schistosoma mansoni cathepsin F (C01 family) 0.0145 0.3558 0.3522
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0309 0.8691 0.8684
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0034 0.0056 0.0064
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0145 0.3558 1
Echinococcus granulosus cathepsin l1 0.01 0.2138 0.2411
Plasmodium vivax vivapain-3 0.0079 0.1476 0.4054
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0145 0.3558 1
Trypanosoma cruzi cysteine proteinase, putative 0.0079 0.1476 0.1644
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0145 0.3558 1
Onchocerca volvulus Cathepsin F homolog 0.0145 0.3558 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0145 0.3558 1
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0119 0.2727 0.2686
Plasmodium vivax vivapain-1 0.0079 0.1476 0.4054
Onchocerca volvulus 0.0145 0.3558 1
Giardia lamblia Cathepsin B precursor 0.0119 0.2727 1
Leishmania major cathepsin L-like protease 0.0145 0.3558 1
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0058 0.0806 0.0755
Echinococcus multilocularis histone acetyltransferase MYST2 0.0066 0.1057 0.1159
Brugia malayi Cathepsin L-like precursor 0.0145 0.3558 0.4056
Trypanosoma cruzi cysteine peptidase, putative 0.0145 0.3558 0.4056
Loa Loa (eye worm) fibroinase 0.0145 0.3558 0.4094
Giardia lamblia Cathepsin B precursor 0.0119 0.2727 1
Echinococcus granulosus cathepsin l1 0.0145 0.3558 0.4056
Brugia malayi cathepsin L-like cysteine proteinase, identical 0.0045 0.0416 0.0417
Loa Loa (eye worm) hypothetical protein 0.0034 0.0056 0.0064
Entamoeba histolytica cysteine protease, putative 0.0079 0.1476 0.4054
Onchocerca volvulus 0.0145 0.3558 1
Entamoeba histolytica cysteine proteinase 2 0.0079 0.1476 0.4054
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0309 0.8691 0.8684
Entamoeba histolytica cysteine protease, putative 0.0079 0.1476 0.4054
Echinococcus granulosus cathepsin l cysteine peptidase 0.0145 0.3558 0.4056
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0145 0.3558 1
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0034 0.0056 0.0064
Entamoeba histolytica cysteine protease, putative 0.0079 0.1476 0.4054
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.01 0.2138 0.5946
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0145 0.3558 1
Echinococcus granulosus cathepsin L cysteine protease 0.0079 0.1476 0.1644
Leishmania major cathepsin L-like protease 0.0145 0.3558 1
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0058 0.0806 0.2143
Onchocerca volvulus 0.0145 0.3558 1
Giardia lamblia Cathepsin B precursor 0.0119 0.2727 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.01 0.2138 0.5946
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0066 0.1057 0.1159
Echinococcus multilocularis polycomb protein SCMH1 0.0058 0.0806 0.0869
Brugia malayi Cathepsin L-like precursor 0.01 0.2138 0.2411
Loa Loa (eye worm) cathepsin B 0.0119 0.2727 0.3137
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0145 0.3558 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0145 0.3558 1
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.0119 0.2727 0.3093
Entamoeba histolytica cysteine protease, putative 0.0079 0.1476 0.4054
Trypanosoma cruzi cysteine peptidase, putative 0.0145 0.3558 0.4056
Trypanosoma cruzi cysteine protease, putative 0.0079 0.1476 0.1644
Trypanosoma cruzi cysteine peptidase (N-terminal), putative 0.0079 0.1476 0.1644
Entamoeba histolytica cysteine proteinase, putative 0.0079 0.1476 0.4054
Leishmania major cathepsin L-like protease 0.0145 0.3558 1
Onchocerca volvulus 0.01 0.2138 0.5946
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0079 0.1476 0.4054
Loa Loa (eye worm) hypothetical protein 0.0034 0.0056 0.0064
Brugia malayi Cathepsin L-like precursor 0.0145 0.3558 0.4056
Brugia malayi Cathepsin L-like precursor 0.0145 0.3558 0.4056
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0066 0.1057 0.1159
Trypanosoma brucei cysteine peptidase C (CPC) 0.0119 0.2727 0.6007
Loa Loa (eye worm) hypothetical protein 0.0045 0.0416 0.0478
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0145 0.3558 1
Entamoeba histolytica cysteine proteinase, putative 0.01 0.2138 0.5946
Entamoeba histolytica cysteine protease, putative 0.0079 0.1476 0.4054
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0145 0.3558 0.4056
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0145 0.3558 1
Entamoeba histolytica cysteine proteinase, putative 0.0145 0.3558 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0145 0.3558 1
Plasmodium vivax unspecified product 0.0079 0.1476 0.4054
Onchocerca volvulus 0.0145 0.3558 1
Onchocerca volvulus 0.0058 0.0806 0.2143
Schistosoma mansoni cathepsin F (C01 family) 0.0145 0.3558 0.3522
Entamoeba histolytica cysteine protease, putative 0.0079 0.1476 0.4054
Toxoplasma gondii cathepsin B 0.0119 0.2727 0.7626
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0145 0.3558 0.4094
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.0309 0.8691 1
Echinococcus multilocularis cathepsin b 0.0309 0.8691 1
Trypanosoma cruzi cysteine peptidase, putative 0.0145 0.3558 0.4056
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0145 0.3558 0.4094
Schistosoma mansoni sex comb on midleg homolog 0.0058 0.0806 0.0755
Schistosoma mansoni cathepsin s 0.0045 0.0416 0.0362
Loa Loa (eye worm) hypothetical protein 0.01 0.2138 0.246
Onchocerca volvulus 0.0145 0.3558 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0145 0.3558 1
Echinococcus multilocularis cathepsin L cysteine protease 0.0145 0.3558 0.4056
Loa Loa (eye worm) hypothetical protein 0.0034 0.0056 0.0064
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0079 0.1476 0.1428
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0227 0.6129 0.7033
Entamoeba histolytica cysteine protease, putative 0.0079 0.1476 0.4054
Leishmania major cysteine peptidase A (CPA) 0.0145 0.3558 1
Entamoeba histolytica cysteine protease, putative 0.0079 0.1476 0.4054
Loa Loa (eye worm) hypothetical protein 0.0066 0.1057 0.1216
Trypanosoma cruzi cysteine peptidase, putative 0.0045 0.0416 0.0417
Schistosoma mansoni sex comb on midleg homolog 0.0058 0.0806 0.0755
Loa Loa (eye worm) cysteine protease 0.0145 0.3558 0.4094
Echinococcus granulosus cathepsin b 0.0309 0.8691 1
Plasmodium falciparum cysteine proteinase falcipain 2a 0.0145 0.3558 1
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0034 0.0077 0.006
Brugia malayi Cathepsin L-like precursor 0.01 0.2138 0.2411
Brugia malayi Cathepsin L-like precursor 0.0145 0.3558 0.4056
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0145 0.3558 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0079 0.1476 0.4054
Echinococcus granulosus cathepsin b 0.0309 0.8691 1
Entamoeba histolytica cysteine proteinase, putative 0.0079 0.1476 0.4054
Plasmodium vivax vivapain-2 0.0145 0.3558 1
Onchocerca volvulus 0.0145 0.3558 1
Plasmodium falciparum cysteine proteinase falcipain 3 0.0145 0.3558 1
Brugia malayi cathepsin L-like precursor 0.01 0.2138 0.2411
Entamoeba histolytica cysteine protease, putative 0.0079 0.1476 0.4054
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0145 0.3558 1
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0079 0.1476 0.1428
Echinococcus granulosus cysteine protease 0.0079 0.1476 0.1644
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0145 0.3558 1
Plasmodium vivax vivapain-2 0.0145 0.3558 1
Leishmania major cathepsin L-like protease 0.0145 0.3558 1
Leishmania major cathepsin L-like protease 0.0145 0.3558 1

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 7.0795 um PUBCHEM_BIOASSAY: qHTS Assay for the Inhibitors of L3MBTL1. (Class of assay: confirmatory) [Related pubchem assays: 485292 (Probe Development Summary for Inhibitors of L3MBTL1)] ChEMBL. No reference
Potency (functional) 29.0929 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) = 35.4813 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human Jumonji Domain Containing 2E (JMJD2E). (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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