Detailed information for compound 1399151

Basic information

Technical information
  • TDR Targets ID: 1399151
  • Name: N-(3-chlorophenyl)-5-(3,4-dihydro-2H-quinolin -1-ylsulfonyl)-2-fluorobenzamide
  • MW: 444.906 | Formula: C22H18ClFN2O3S
  • H donors: 1 H acceptors: 3 LogP: 4.58 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1cccc(c1)NC(=O)c1cc(ccc1F)S(=O)(=O)N1CCCc2c1cccc2
  • InChi: 1S/C22H18ClFN2O3S/c23-16-7-3-8-17(13-16)25-22(27)19-14-18(10-11-20(19)24)30(28,29)26-12-4-6-15-5-1-2-9-21(15)26/h1-3,5,7-11,13-14H,4,6,12H2,(H,25,27)
  • InChiKey: DQPBIJDCSFTILE-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-(3-chlorophenyl)-5-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-2-fluoro-benzamide
  • Oprea1_671985
  • K781-8367
  • NCGC00139276-01

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens SMAD family member 2 Starlite/ChEMBL No references
Homo sapiens microtubule-associated protein tau Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Loa Loa (eye worm) transcription factor SMAD2 Get druggable targets OG5_131716 All targets in OG5_131716
Echinococcus granulosus microtubule associated protein 2 Get druggable targets OG5_133504 All targets in OG5_133504
Brugia malayi MH2 domain containing protein Get druggable targets OG5_131716 All targets in OG5_131716
Schistosoma mansoni microtubule-associated protein tau Get druggable targets OG5_133504 All targets in OG5_133504
Loa Loa (eye worm) MH2 domain-containing protein Get druggable targets OG5_131716 All targets in OG5_131716
Schistosoma japonicum ko:K04380 microtubule-associated protein tau, putative Get druggable targets OG5_133504 All targets in OG5_133504
Echinococcus multilocularis microtubule associated protein 2 Get druggable targets OG5_133504 All targets in OG5_133504
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi MH2 domain containing protein SMAD family member 2 467 aa 405 aa 31.6 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.0589 0.3252 0.4762
Brugia malayi ephrin receptor 1 precursor 0.0106 0.0135 0.0381
Echinococcus granulosus growth factor receptor bound protein 2 0.0173 0.0566 0.0828
Loa Loa (eye worm) TK/FER protein kinase 0.0117 0.0201 0.0274
Echinococcus granulosus tyrosine protein kinase HCK 0.0416 0.2134 0.3126
Brugia malayi SH2 domain containing protein 0.0212 0.0816 0.2305
Echinococcus granulosus tensin C1 domain containing phosphatase 0.0088 0.0014 0.002
Echinococcus multilocularis tyrosine protein kinase Abl 0.0594 0.3286 0.4813
Schistosoma mansoni tyrosine kinase 0.0589 0.3252 0.5192
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0088 0.0014 0.0039
Brugia malayi Protein kinase domain containing protein 0.0117 0.0201 0.0567
Echinococcus multilocularis N chimaerin 0.0088 0.0014 0.002
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.0589 0.3252 0.4762
Schistosoma mansoni tyrosine kinase 0.0589 0.3252 0.5192
Schistosoma mansoni suppressor of cytokine signaling 0.0088 0.0014 0.0022
Echinococcus multilocularis suppressor of cytokine signaling 7 0.0088 0.0014 0.002
Echinococcus multilocularis SH2 domain containing protein 7 0.0088 0.0014 0.002
Echinococcus granulosus guanine nucleotide exchange factor VAV2 0.0088 0.0014 0.002
Loa Loa (eye worm) TK protein kinase 0.0416 0.2134 0.3112
Echinococcus granulosus SH2 motif 0.0088 0.0014 0.002
Schistosoma mansoni vav2 0.0088 0.0014 0.0022
Brugia malayi SH2 domain containing protein 0.0088 0.0014 0.0039
Brugia malayi Sex muscle abnormal protein 5 0.0173 0.0566 0.1597
Brugia malayi SH2 domain containing protein 0.0088 0.0014 0.0039
Brugia malayi SH2 domain containing protein 0.0088 0.0014 0.0039
Schistosoma mansoni suppressor of cytokine signaling 0.0088 0.0014 0.0022
Echinococcus granulosus suppressor of cytokine signaling 7 0.0088 0.0014 0.002
Onchocerca volvulus 0.0117 0.0201 0.236
Onchocerca volvulus 0.0088 0.0014 0.0039
Echinococcus multilocularis tyrosine protein kinase csk 0.0124 0.0251 0.0367
Leishmania major mitogen-activated protein kinase 3, putative,map kinase 3, putative 0.0379 0.1897 0.5
Schistosoma mansoni tyrosine-protein kinase zap-70 0.0088 0.0014 0.0022
Schistosoma mansoni tyrosine kinase 0.1055 0.6262 1
Echinococcus multilocularis tensin 0.0088 0.0014 0.002
Echinococcus granulosus tyrosine protein kinase ABL1 0.1143 0.6828 1
Brugia malayi Tyrosine-protein kinase abl-1 0.0634 0.3541 1
Echinococcus multilocularis tyrosine protein kinase csk 0.0124 0.0251 0.0367
Loa Loa (eye worm) TK/FER protein kinase 0.0117 0.0201 0.0274
Brugia malayi cytokine inducible SH2-containing protein 5 0.0088 0.0014 0.0039
Brugia malayi Variant SH3 domain containing protein 0.0173 0.0566 0.1597
Brugia malayi Tyrosine-protein kinase abl-1 0.0594 0.3286 0.928
Brugia malayi Protein kinase domain containing protein 0.0117 0.0201 0.0567
Echinococcus multilocularis tyrosine protein kinase csk 0.0124 0.0251 0.0367
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.0589 0.3252 0.4762
Echinococcus multilocularis suppressor of cytokine signaling 7 0.0088 0.0014 0.002
Echinococcus multilocularis suppressor of cytokine signaling 6 0.0088 0.0014 0.002
Echinococcus granulosus insulin growth factor 1 receptor beta 0.0176 0.0585 0.0856
Echinococcus multilocularis tyrosine protein kinase Blk 0.0504 0.27 0.3954
Echinococcus multilocularis microtubule associated protein 2 0.0833 0.4829 0.7072
Echinococcus granulosus epidermal growth factor receptor 0.0475 0.2516 0.3686
Trypanosoma cruzi mitogen-activated protein kinase 3, putative 0.0379 0.1897 0.5
Schistosoma mansoni growth factor receptor-bound protein 0.0173 0.0566 0.0903
Echinococcus granulosus tyrosine protein phosphatase non receptor type 0.0088 0.0014 0.002
Schistosoma mansoni tensin 0.0088 0.0014 0.0022
Echinococcus multilocularis insulin growth factor 1 receptor beta 0.0176 0.0585 0.0856
Echinococcus multilocularis tyrosine protein kinase Src64B 0.0589 0.3252 0.4762
Echinococcus multilocularis signal transduction protein lnk realted 0.0088 0.0014 0.002
Entamoeba histolytica SH2-protein kinase domain containing protein 0.0089 0.0025 0.0052
Echinococcus multilocularis mitogen activated protein kinase 11 0.0379 0.1897 0.2778
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0475 0.2513 0.3681
Echinococcus granulosus tyrosine protein kinase Blk 0.0504 0.27 0.3954
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0589 0.3252 0.4762
Loa Loa (eye worm) hypothetical protein 0.0173 0.0566 0.0809
Echinococcus multilocularis tyrosine protein kinase ABL1 0.1143 0.6828 1
Echinococcus granulosus SHC transforming protein 3 0.0088 0.0014 0.002
Schistosoma mansoni tensin-related 0.0088 0.0014 0.0022
Loa Loa (eye worm) TK/CSK protein kinase 0.0124 0.0251 0.0347
Echinococcus granulosus tyrosine protein kinase Btk29A 0.0202 0.0753 0.1102
Echinococcus granulosus tyrosine protein kinase csk 0.0124 0.0251 0.0367
Onchocerca volvulus Suppressor of cytokine signaling at 36E homolog 0.0088 0.0014 0.0039
Loa Loa (eye worm) SRC-1 0.0589 0.3252 0.4752
Brugia malayi Furin-like cysteine rich region family protein 0.0475 0.2516 0.7106
Brugia malayi STAT protein, DNA binding domain containing protein 0.0088 0.0014 0.0039
Schistosoma mansoni chimerin-related rho-gtpase-activating protein 0.0088 0.0014 0.0022
Loa Loa (eye worm) TK/EPH protein kinase 0.0238 0.0986 0.1427
Schistosoma mansoni nck2/grb4 0.0173 0.0566 0.0903
Entamoeba histolytica protein kinase, putative 0.0089 0.0025 0.0052
Echinococcus granulosus tyrosine protein kinase csk 0.0124 0.0251 0.0367
Echinococcus granulosus epidermal growth factor receptor 0.0268 0.1176 0.1722
Schistosoma mansoni signal transduction protein lnk-related 0.0088 0.0014 0.0022
Echinococcus granulosus ephrin type A receptor 4 A 0.0232 0.0948 0.1389
Echinococcus granulosus N chimaerin 0.0088 0.0014 0.002
Brugia malayi hypothetical protein 0.0117 0.0201 0.0567
Schistosoma mansoni shc transforming protein 0.0088 0.0014 0.0022
Brugia malayi tRNA modification GTPase TrmE family protein 0.0088 0.0014 0.0039
Echinococcus multilocularis tyrosine protein kinase csk 0.0124 0.0251 0.0367
Brugia malayi Protein kinase domain containing protein 0.017 0.0545 0.1538
Loa Loa (eye worm) TK protein kinase 0.0504 0.27 0.3942
Echinococcus granulosus microtubule associated protein 2 0.0833 0.4829 0.7072
Echinococcus multilocularis SHC transforming protein 3 0.0088 0.0014 0.002
Loa Loa (eye worm) TK/FER protein kinase 0.0117 0.0201 0.0274
Loa Loa (eye worm) TK/FER protein kinase 0.0117 0.0201 0.0274
Echinococcus multilocularis phosphatidylinositol 3 kinase regulatory subunit 0.0088 0.0014 0.002
Onchocerca volvulus 0.0117 0.0201 0.236
Echinococcus granulosus tyrosine protein kinase Srms 0.0117 0.0201 0.0294
Schistosoma mansoni tyrosine kinase 0.0297 0.1368 0.2184
Brugia malayi SH2 domain containing protein 0.0117 0.0201 0.0567
Trypanosoma cruzi mitogen-activated protein kinase 3, putative 0.0379 0.1897 0.5
Echinococcus granulosus hypothetical protein 0.0088 0.0014 0.002
Echinococcus granulosus c src tyrosine kinase 0.0297 0.1368 0.2003
Loa Loa (eye worm) CMGC/MAPK/P38 protein kinase 0.0379 0.1897 0.2763
Echinococcus multilocularis c src tyrosine kinase 0.0297 0.1368 0.2003
Echinococcus granulosus SH2 motif 0.0088 0.0014 0.002
Entamoeba histolytica SH2-protein kinase domain containing protein 0.0117 0.0201 0.0882
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.0589 0.3252 0.4762
Echinococcus multilocularis SH2 motif 0.0088 0.0014 0.002
Loa Loa (eye worm) TK/EGFR protein kinase 0.0475 0.2516 0.3673
Onchocerca volvulus Suppressor of cytokine signaling 7 homolog 0.0088 0.0014 0.0039
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0589 0.3252 0.4762
Echinococcus multilocularis epidermal growth factor receptor 0.0268 0.1176 0.1722
Loa Loa (eye worm) hypothetical protein 0.0421 0.2169 0.3163
Loa Loa (eye worm) TK/ABL protein kinase 0.1143 0.6828 1
Schistosoma mansoni serine/threonine protein kinase 0.0114 0.0187 0.0298
Brugia malayi P38 map kinase family protein 2 0.0379 0.1897 0.5356
Echinococcus granulosus tyrosine protein phosphatase non receptor type 0.0088 0.0014 0.002
Echinococcus granulosus tyrosine protein kinase Fyn 0.0589 0.3252 0.4762
Echinococcus granulosus tyrosine protein kinase Src42A 0.0475 0.2513 0.3681
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0589 0.3252 0.4762
Echinococcus multilocularis tyrosine kinase 0.0117 0.0201 0.0294
Schistosoma mansoni tyrosine kinase 0.0268 0.1176 0.1877
Echinococcus granulosus SH2 domain containing adapter protein F 0.0088 0.0014 0.002
Echinococcus granulosus tyrosine kinase|tyrosine protein kinase Fyn 0.0504 0.27 0.3954
Schistosoma mansoni tyrosine kinase 0.0475 0.2516 0.4018
Schistosoma mansoni tensin-related 0.0088 0.0014 0.0022
Schistosoma mansoni tyrosine kinase 0.0239 0.0989 0.1579
Brugia malayi Protein kinase domain containing protein 0.0117 0.0201 0.0567
Echinococcus granulosus tyrosine protein kinase shark 0.0117 0.0201 0.0294
Echinococcus multilocularis tensin 0.0088 0.0014 0.002
Echinococcus granulosus NCK adaptor protein 0.0173 0.0566 0.0828
Echinococcus multilocularis tyrosine protein kinase Btk29A 0.0202 0.0753 0.1102
Echinococcus multilocularis insulin receptor 0.017 0.0545 0.0798
Schistosoma mansoni microtubule-associated protein tau 0.0833 0.4829 0.7711
Echinococcus granulosus signal transduction protein lnk realted 0.0088 0.0014 0.002
Schistosoma mansoni proto-oncogene tyrosine-protein kinase abl1 0.0173 0.0566 0.0903
Echinococcus multilocularis growth factor receptor bound protein 2 0.0173 0.0566 0.0828
Brugia malayi SH2 domain containing protein 0.0088 0.0014 0.0039
Echinococcus granulosus expressed conserved protein 0.0088 0.0014 0.002
Brugia malayi SRC-1 0.0589 0.3252 0.9182
Onchocerca volvulus 0.0117 0.0201 0.236
Echinococcus granulosus phosphatidylinositol 3 kinase regulatory subunit 0.0088 0.0014 0.002
Onchocerca volvulus 0.0088 0.0014 0.0039
Trypanosoma brucei mitogen-activated protein kinase 3, putative 0.0379 0.1897 0.5
Schistosoma mansoni GTPase activating protein 0.0088 0.0014 0.0022
Loa Loa (eye worm) TK/INSR protein kinase 0.017 0.0545 0.0779
Loa Loa (eye worm) TK/FER protein kinase 0.0117 0.0201 0.0274
Echinococcus granulosus suppressor of cytokine signaling 6 0.0088 0.0014 0.002
Echinococcus multilocularis guanine nucleotide exchange factor VAV2 0.0088 0.0014 0.002
Schistosoma mansoni tyrosine kinase 0.0202 0.0753 0.1202
Echinococcus granulosus tyrosine kinase 0.0117 0.0201 0.0294
Echinococcus granulosus tyrosine kinase 0.0504 0.27 0.3954
Brugia malayi hypothetical protein 0.0088 0.0014 0.0039
Echinococcus multilocularis tyrosine protein kinase HCK 0.0416 0.2134 0.3126
Brugia malayi RhoGAP domain containing protein 0.0088 0.0014 0.0039
Schistosoma mansoni tyrosine kinase 0.0268 0.1176 0.1877
Echinococcus multilocularis mitogen activated protein kinase 11 0.0379 0.1897 0.2778
Echinococcus multilocularis mitogen activated protein kinase 14 0.0379 0.1897 0.2778
Schistosoma mansoni tyrosine kinase 0.0117 0.0201 0.0321
Schistosoma mansoni tyrosine kinase 0.0239 0.0989 0.1579
Onchocerca volvulus 0.0088 0.0014 0.0039
Echinococcus granulosus tyrosine protein kinase Fyn 0.0589 0.3252 0.4762
Brugia malayi Protein kinase domain containing protein 0.0117 0.0201 0.0567
Entamoeba histolytica protein kinase, putative 0.0416 0.2134 1
Brugia malayi MH2 domain containing protein 0.0144 0.0379 0.1071
Brugia malayi SH2 domain containing protein 0.0088 0.0014 0.0039
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0589 0.3252 0.4762
Onchocerca volvulus 0.0088 0.0014 0.0039
Echinococcus granulosus insulin receptor 0.017 0.0545 0.0798
Schistosoma mansoni hypothetical protein 0.0088 0.0014 0.0022
Loa Loa (eye worm) variant SH3 domain-containing protein 0.0173 0.0566 0.0809
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0504 0.27 0.3954
Echinococcus multilocularis SH2 motif 0.0088 0.0014 0.002
Onchocerca volvulus 0.0088 0.0014 0.0039
Loa Loa (eye worm) TK/FER protein kinase 0.0117 0.0201 0.0274
Loa Loa (eye worm) TK/FER protein kinase 0.0117 0.0201 0.0274
Echinococcus granulosus melanoma receptor tyrosine protein kinase 0.0268 0.1176 0.1722
Schistosoma mansoni protein tyrosine phosphatase n11 (shp2) 0.0088 0.0014 0.0022
Schistosoma mansoni tyrosine kinase 0.017 0.0545 0.087
Brugia malayi Protein kinase domain containing protein 0.0117 0.0201 0.0567
Echinococcus multilocularis ephrin type A receptor 4 A 0.0232 0.0948 0.1389
Echinococcus multilocularis SH2 motif 0.0088 0.0014 0.002
Schistosoma mansoni hypothetical protein 0.0088 0.0014 0.0022
Brugia malayi Variant SH3 domain containing protein 0.0088 0.0014 0.0039
Echinococcus multilocularis tyrosine protein kinase shark 0.0117 0.0201 0.0294
Loa Loa (eye worm) hypothetical protein 0.0164 0.0509 0.0726
Brugia malayi SH2 domain containing protein 0.0088 0.0014 0.0039
Schistosoma mansoni tyrosine kinase 0.0239 0.0989 0.1579
Echinococcus multilocularis mitogen activated protein kinase 14 0.0379 0.1897 0.2778
Schistosoma mansoni tyrosine kinase 0.0117 0.0201 0.0321
Schistosoma mansoni SH2A 0.0088 0.0014 0.0022
Brugia malayi SH2 domain containing protein 0.0088 0.0014 0.0039
Echinococcus multilocularis tyrosine protein phosphatase non receptor type 0.0088 0.0014 0.002
Schistosoma mansoni chimerin-related rho-gtpase-activating protein 0.0088 0.0014 0.0022
Loa Loa (eye worm) MH2 domain-containing protein 0.0144 0.0379 0.0536
Echinococcus multilocularis tyrosine protein kinase Srms 0.0504 0.27 0.3954
Schistosoma mansoni adapter molecule crk 0.0173 0.0566 0.0903
Loa Loa (eye worm) TK/FER protein kinase 0.0117 0.0201 0.0274
Echinococcus multilocularis tyrosine protein kinase Fgr 0.0589 0.3252 0.4762
Echinococcus granulosus tyrosine protein kinase Src42A 0.0589 0.3252 0.4762
Brugia malayi Variant SH3 domain containing protein 0.0173 0.0566 0.1597
Echinococcus granulosus tyrosine protein kinase Fyn 0.0589 0.3252 0.4762
Loa Loa (eye worm) sex muscle abnormal protein 5 0.0173 0.0566 0.0809
Schistosoma mansoni growth factor receptor-bound protein 0.0173 0.0566 0.0903
Brugia malayi Variant SH3 domain containing protein 0.0088 0.0014 0.0039
Schistosoma mansoni proto-oncogene tyrosine-protein kinase src 0.0202 0.0753 0.1202
Echinococcus multilocularis 0.0088 0.0014 0.002
Echinococcus granulosus mitogen activated protein kinase 11 0.0379 0.1897 0.2778
Schistosoma mansoni ephrin receptor 0.0193 0.0696 0.1111
Loa Loa (eye worm) transcription factor SMAD2 0.0144 0.0379 0.0536
Echinococcus multilocularis tyrosine protein phosphatase non receptor type 0.0088 0.0014 0.002
Loa Loa (eye worm) hypothetical protein 0.0117 0.0201 0.0274
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.0589 0.3252 0.4762
Schistosoma mansoni tensin 0.0088 0.0014 0.0022
Echinococcus granulosus SH2 domain containing protein 7 0.0088 0.0014 0.002
Echinococcus multilocularis epidermal growth factor receptor 0.0475 0.2516 0.3686
Echinococcus multilocularis NCK adaptor protein 0.0173 0.0566 0.0828
Echinococcus multilocularis SH2 domain containing adapter protein F 0.0088 0.0014 0.002
Brugia malayi Tensin 0.0088 0.0014 0.0039
Schistosoma mansoni tensin 0.0088 0.0014 0.0022
Echinococcus multilocularis 0.0139 0.0345 0.0506
Echinococcus granulosus tyrosine protein kinase csk 0.0124 0.0251 0.0367
Onchocerca volvulus 0.0117 0.0201 0.236
Schistosoma mansoni tyrosine kinase 0.017 0.0545 0.087
Loa Loa (eye worm) TK/FER protein kinase 0.0117 0.0201 0.0274
Echinococcus granulosus tyrosine protein kinase Lyn 0.0591 0.3262 0.4778
Onchocerca volvulus 0.0164 0.0509 0.618
Onchocerca volvulus 0.0117 0.0201 0.236
Brugia malayi protein-tyrosine kinase 0.0504 0.27 0.7624
Loa Loa (eye worm) TK/FER protein kinase 0.0117 0.0201 0.0274
Echinococcus granulosus tyrosine protein kinase Fps85D 0.0117 0.0201 0.0294
Onchocerca volvulus 0.0088 0.0014 0.0039
Echinococcus granulosus tyrosine protein kinase Src64B 0.0589 0.3252 0.4762
Echinococcus multilocularis tyrosine protein kinase Fps85D 0.0117 0.0201 0.0294
Onchocerca volvulus 0.0212 0.0816 1
Echinococcus granulosus mitogen activated protein kinase 14 0.0379 0.1897 0.2778
Loa Loa (eye worm) SH2 domain-containing protein 0.0183 0.0629 0.0903
Echinococcus granulosus tensin 0.0088 0.0014 0.002

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 5.0119 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 (functional) = 17.7828 um PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Fluorescence Polarization. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (functional) 17.7828 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588856, AID588860] ChEMBL. No reference
Potency (functional) 22.3872 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: qHTS Screen for Compounds that Selectively Target Cancer Cells with p53 Mutations: Cytotoxicity of p53ts Cells at the Permissive Temperature. (Class of assay: confirmatory) [Related pubchem assays: 902 ] 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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