Detailed information for compound 1877455

Basic information

Technical information
  • TDR Targets ID: 1877455
  • Name: N-[[5-chloro-1-(4-chlorophenyl)-3-methylpyraz ol-4-yl]methylideneamino]-4-(thiophen-2-ylsul fonylamino)benzamide
  • MW: 534.438 | Formula: C22H17Cl2N5O3S2
  • H donors: 2 H acceptors: 4 LogP: 5.33 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 2
  • SMILES: Clc1ccc(cc1)n1nc(c(c1Cl)/C=N/NC(=O)c1ccc(cc1)NS(=O)(=O)c1cccs1)C
  • InChi: 1S/C22H17Cl2N5O3S2/c1-14-19(21(24)29(27-14)18-10-6-16(23)7-11-18)13-25-26-22(30)15-4-8-17(9-5-15)28-34(31,32)20-3-2-12-33-20/h2-13,28H,1H3,(H,26,30)/b25-13+
  • InChiKey: QGPCRLUSDYAPAL-DHRITJCHSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-[[5-chloro-1-(4-chlorophenyl)-3-methyl-pyrazol-4-yl]methyleneamino]-4-(2-thienylsulfonylamino)benzamide
  • N-[[5-chloro-1-(4-chlorophenyl)-3-methyl-4-pyrazolyl]methyleneamino]-4-(2-thienylsulfonylamino)benzamide
  • N-[[5-chloro-1-(4-chlorophenyl)-3-methyl-pyrazol-4-yl]methylideneamino]-4-(thiophen-2-ylsulfonylamino)benzamide
  • T0517-3660
  • MLS000374624
  • SMR000244239

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens GNAS complex locus Starlite/ChEMBL No references
Streptococcus pyogenes serotype M1 Streptokinase A Starlite/ChEMBL No references
Staphylococcus aureus (strain N315) Probable nicotinate-nucleotide adenylyltransferase Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Leishmania infantum basic transcription factor 3a, putative Get druggable targets OG5_127333 All targets in OG5_127333
Neospora caninum hypothetical protein Get druggable targets OG5_127333 All targets in OG5_127333
Trypanosoma cruzi transcription factor btf3, putative Get druggable targets OG5_127333 All targets in OG5_127333
Mycobacterium leprae PROBABLE NICOTINATE-NUCLEOTIDE ADENYLYLTRANSFERASE NADD (DEAMIDO-NAD(+) PYROPHOSPHORYLASE) (DEAMIDO-NAD(+) DIPHOSPHORYLASE) (NIC Get druggable targets OG5_131883 All targets in OG5_131883
Leishmania braziliensis basic transcription factor 3a, putative Get druggable targets OG5_127333 All targets in OG5_127333
Entamoeba histolytica transcription factor BTF3, putative Get druggable targets OG5_127333 All targets in OG5_127333
Plasmodium berghei nicotinamide/nicotinic acid mononucleotide adenylyltransferase, putative Get druggable targets OG5_131883 All targets in OG5_131883
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_127333 All targets in OG5_127333
Plasmodium falciparum nicotinamide/nicotinic acid mononucleotide adenylyltransferase Get druggable targets OG5_131883 All targets in OG5_131883
Plasmodium yoelii Predicted nucleotidyltransferase, putative Get druggable targets OG5_131883 All targets in OG5_131883
Plasmodium vivax basic transcription factor 3b, putative Get druggable targets OG5_127333 All targets in OG5_127333
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_127333 All targets in OG5_127333
Leishmania donovani transcription factor btf3, putative Get druggable targets OG5_127333 All targets in OG5_127333
Echinococcus granulosus transcription factor btf3 Get druggable targets OG5_127333 All targets in OG5_127333
Theileria parva hypothetical protein, conserved Get druggable targets OG5_131883 All targets in OG5_131883
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma japonicum ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Leishmania mexicana basic transcription factor 3a, putative Get druggable targets OG5_127333 All targets in OG5_127333
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative Get druggable targets OG5_131088 All targets in OG5_131088
Trypanosoma brucei gambiense nascent polypeptide associated complex alpha subunit, putative Get druggable targets OG5_127333 All targets in OG5_127333
Candida albicans similar to S. cerevisiae GAL4 enhancer protein EGD1 (YPL037C) subunit alpha of the nascent polypeptide-associated chaperone comp Get druggable targets OG5_127333 All targets in OG5_127333
Entamoeba histolytica hypothetical protein Get druggable targets OG5_127333 All targets in OG5_127333
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Toxoplasma gondii NAC domain-containing protein Get druggable targets OG5_127333 All targets in OG5_127333
Schistosoma mansoni transcription factor btf3 Get druggable targets OG5_127333 All targets in OG5_127333
Treponema pallidum hypothetical protein Get druggable targets OG5_131883 All targets in OG5_131883
Mycobacterium ulcerans bifunctional nicotinate-nucleotide adenylyltransferase NadD/hypothetical protein Get druggable targets OG5_131883 All targets in OG5_131883
Mycobacterium tuberculosis Probable nicotinate-nucleotide adenylyltransferase NadD (deamido-NAD(+) pyrophosphorylase) (deamido-NAD(+) diphosphorylase) (nic Get druggable targets OG5_131883 All targets in OG5_131883
Loa Loa (eye worm) ICD-1 protein Get druggable targets OG5_127333 All targets in OG5_127333
Trypanosoma cruzi transcription factor btf3, putative Get druggable targets OG5_127333 All targets in OG5_127333
Plasmodium knowlesi nicotinamide/nicotinic acid mononucleotide adenylyltransferase, putative Get druggable targets OG5_131883 All targets in OG5_131883
Cryptosporidium hominis NAC domain protein Get druggable targets OG5_127333 All targets in OG5_127333
Plasmodium yoelii basic transcription factor 3, putative Get druggable targets OG5_127333 All targets in OG5_127333
Babesia bovis cytidylyltransferase family protein Get druggable targets OG5_131883 All targets in OG5_131883
Babesia bovis NAC domain containing protein Get druggable targets OG5_127333 All targets in OG5_127333
Theileria parva transcription factor BTF3, putative Get druggable targets OG5_127333 All targets in OG5_127333
Brugia malayi beta-NAC-like protein Get druggable targets OG5_127333 All targets in OG5_127333
Plasmodium berghei transcription factor 3b, putative Get druggable targets OG5_127333 All targets in OG5_127333
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_127333 All targets in OG5_127333
Candida albicans similar to S. cerevisiae GAL4 enhancer protein EGD1 (YPL037C) subunit alpha of the nascent polypeptide-associated chaperone comp Get druggable targets OG5_127333 All targets in OG5_127333
Plasmodium falciparum basic transcription factor 3b, putative Get druggable targets OG5_127333 All targets in OG5_127333
Plasmodium knowlesi basic transcription factor 3b, putative Get druggable targets OG5_127333 All targets in OG5_127333
Leishmania major basic transcription factor 3a, putative Get druggable targets OG5_127333 All targets in OG5_127333
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain Get druggable targets OG5_131088 All targets in OG5_131088
Cryptosporidium parvum BTF domain, basal transcription factor Get druggable targets OG5_127333 All targets in OG5_127333
Plasmodium vivax nicotinate-nucleotide adenylyltransferase, putative Get druggable targets OG5_131883 All targets in OG5_131883
Echinococcus multilocularis transcription factor btf3 Get druggable targets OG5_127333 All targets in OG5_127333
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Trypanosoma brucei transcription factor BTF3, putative Get druggable targets OG5_127333 All targets in OG5_127333
Schistosoma japonicum ko:K01527 nascent polypeptide-associated complex subunit beta, putative Get druggable targets OG5_127333 All targets in OG5_127333
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Entamoeba histolytica nicotinamide nucleotide adenylyltransferase, putative Probable nicotinate-nucleotide adenylyltransferase   189 aa 204 aa 24.5 %
Trichomonas vaginalis nicotinamide mononucleotide adenylyltransferase, putative Probable nicotinate-nucleotide adenylyltransferase   189 aa 210 aa 23.8 %
Schistosoma mansoni GTP-binding protein alpha subunit gna GNAS complex locus 394 aa 450 aa 28.7 %
Trypanosoma cruzi hypothetical protein, conserved Probable nicotinate-nucleotide adenylyltransferase   189 aa 200 aa 21.0 %
Trypanosoma cruzi hypothetical protein, conserved Probable nicotinate-nucleotide adenylyltransferase   189 aa 200 aa 20.5 %
Trichomonas vaginalis nicotinamide mononucleotide adenylyltransferase, putative Probable nicotinate-nucleotide adenylyltransferase   189 aa 205 aa 19.0 %
Plasmodium knowlesi cytoskeleton associated protein, putative Probable nicotinate-nucleotide adenylyltransferase   189 aa 170 aa 23.5 %
Trypanosoma brucei variant surface glycoprotein (VSG, atypical), putative Probable nicotinate-nucleotide adenylyltransferase   189 aa 171 aa 20.5 %
Giardia lamblia Nicotinamide-nucleotide adenylyltransferase Probable nicotinate-nucleotide adenylyltransferase   189 aa 153 aa 24.2 %
Giardia lamblia Nicotinamide-nucleotide adenylyltransferase Probable nicotinate-nucleotide adenylyltransferase   189 aa 247 aa 20.6 %
Entamoeba histolytica NMN adenylyltransferase, putative Probable nicotinate-nucleotide adenylyltransferase   189 aa 204 aa 24.5 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Toxoplasma gondii ABC1 family protein 0.0051 0.0255 1
Schistosoma mansoni glutaminase 0.0166 0.2338 1
Mycobacterium tuberculosis Probable lipase LipD 0.0051 0.0255 0.046
Toxoplasma gondii hypothetical protein 0.005 0.0234 0.9161
Brugia malayi beta-lactamase family protein 0.0051 0.0255 0.0716
Loa Loa (eye worm) hypothetical protein 0.0051 0.0255 0.0676
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.033 0.1411
Echinococcus granulosus transcription factor btf3 0.0042 0.0095 0.0095
Trypanosoma brucei hypothetical protein, conserved 0.0051 0.0255 1
Loa Loa (eye worm) hypothetical protein 0.0078 0.0747 0.2746
Plasmodium vivax hypothetical protein, conserved 0.0051 0.0255 0.0294
Loa Loa (eye worm) matrix metalloproteinase 0.0078 0.0747 0.2746
Onchocerca volvulus 0.0086 0.0889 0.2862
Trypanosoma cruzi hypothetical protein, conserved 0.0051 0.0255 1
Trypanosoma cruzi hypothetical protein, conserved 0.0051 0.0255 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.033 0.033
Toxoplasma gondii NAC domain-containing protein 0.0042 0.0095 0.3714
Plasmodium vivax transporter, putative 0.005 0.0234 0.0255
Loa Loa (eye worm) matrixin family protein 0.0174 0.247 1
Loa Loa (eye worm) matrixin family protein 0.0165 0.2304 0.93
Trichomonas vaginalis D-aminoacylase, putative 0.0051 0.0255 0.0716
Mycobacterium tuberculosis Conserved protein 0.0051 0.0255 0.046
Loa Loa (eye worm) hypothetical protein 0.0051 0.0255 0.0676
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0071 0.061 0.2298
Onchocerca volvulus 0.0078 0.0747 0.2221
Entamoeba histolytica transcription factor BTF3, putative 0.0042 0.0095 0.5
Brugia malayi Calcitonin receptor-like protein seb-1 0.0071 0.061 0.2298
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0051 0.0255 0.046
Mycobacterium tuberculosis Probable peptidoglycan hydrolase 0.0095 0.1056 0.19
Mycobacterium leprae PROBABLE HYDROLASE 0.0095 0.1056 0.151
Mycobacterium leprae PROBABLE NICOTINATE-NUCLEOTIDE ADENYLYLTRANSFERASE NADD (DEAMIDO-NAD(+) PYROPHOSPHORYLASE) (DEAMIDO-NAD(+) DIPHOSPHORYLASE) (NIC 0.0345 0.5555 1
Trichomonas vaginalis glutaminase, putative 0.0166 0.2338 1
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0051 0.0255 0.0716
Mycobacterium tuberculosis Conserved protein 0.0051 0.0255 0.046
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0055 0.033 0.0989
Loa Loa (eye worm) hypothetical protein 0.0051 0.0255 0.0676
Schistosoma mansoni transcription factor btf3 0.0042 0.0095 0.0406
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0051 0.0255 0.1092
Echinococcus multilocularis beta LACTamase domain containing family member 0.0051 0.0255 0.0255
Brugia malayi Matrix metalloprotease, N-terminal domain containing protein 0.0095 0.1056 0.4283
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.033 0.1411
Brugia malayi beta-lactamase 0.0051 0.0255 0.0716
Mycobacterium tuberculosis Probable nicotinate-nucleotide adenylyltransferase NadD (deamido-NAD(+) pyrophosphorylase) (deamido-NAD(+) diphosphorylase) (nic 0.0345 0.5555 1
Brugia malayi Matrixin family protein 0.0078 0.0747 0.2909
Mycobacterium ulcerans beta-lactamase 0.0051 0.0255 0.046
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0591 1 1
Schistosoma mansoni hypothetical protein 0.0048 0.0206 0.0881
Brugia malayi Matrixin family protein 0.0165 0.2304 0.985
Leishmania major hypothetical protein, conserved 0.0051 0.0255 1
Loa Loa (eye worm) hypothetical protein 0.0051 0.0255 0.0676
Treponema pallidum hypothetical protein 0.0345 0.5555 0.5
Trichomonas vaginalis D-aminoacylase, putative 0.0051 0.0255 0.0716
Plasmodium vivax hypothetical protein, conserved 0.005 0.0234 0.0255
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0071 0.061 0.217
Mycobacterium ulcerans bifunctional nicotinate-nucleotide adenylyltransferase NadD/hypothetical protein 0.0345 0.5555 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.033 0.033
Mycobacterium tuberculosis Conserved protein 0.0051 0.0255 0.046
Schistosoma mansoni matrix metallopeptidase-7 (M10 family) 0.0078 0.0747 0.3196
Entamoeba histolytica hypothetical protein 0.0042 0.0095 0.5
Mycobacterium ulcerans lipase LipD 0.0051 0.0255 0.046
Mycobacterium tuberculosis Probable lipase LipE 0.0051 0.0255 0.046
Mycobacterium tuberculosis Probable hydrolase 0.0051 0.0255 0.046
Brugia malayi glutaminase DH11.1 0.0166 0.2338 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.033 0.1411
Echinococcus multilocularis conserved hypothetical protein 0.0072 0.0626 0.0626
Brugia malayi beta-lactamase family protein 0.0051 0.0255 0.0716
Loa Loa (eye worm) hypothetical protein 0.0095 0.1056 0.4044
Loa Loa (eye worm) beta-lactamase 0.0051 0.0255 0.0676
Loa Loa (eye worm) glutaminase 2 0.0166 0.2338 0.9442
Mycobacterium ulcerans esterase/lipase LipP 0.0051 0.0255 0.046
Schistosoma mansoni hypothetical protein 0.0086 0.0889 0.3804
Mycobacterium ulcerans glutaminase 0.0166 0.2338 0.4209
Mycobacterium tuberculosis Probable esterase LipL 0.0051 0.0255 0.046
Trichomonas vaginalis D-aminoacylase, putative 0.0051 0.0255 0.0716
Mycobacterium ulcerans hypothetical protein 0.0051 0.0255 0.046
Trichomonas vaginalis penicillin-binding protein, putative 0.0051 0.0255 0.0716
Brugia malayi Matrixin family protein 0.0078 0.0747 0.2909
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.033 0.033
Trichomonas vaginalis penicillin-binding protein, putative 0.0051 0.0255 0.0716
Plasmodium vivax nicotinate-nucleotide adenylyltransferase, putative 0.0345 0.5555 1
Brugia malayi latrophilin 2 splice variant baaae 0.0048 0.0206 0.0495
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0051 0.0255 0.046
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0055 0.033 0.1048
Echinococcus multilocularis transcription factor btf3 0.0042 0.0095 0.0095
Loa Loa (eye worm) hypothetical protein 0.0051 0.0255 0.0676
Loa Loa (eye worm) glutaminase 0.0166 0.2338 0.9442
Echinococcus multilocularis matrix metallopeptidase 7 (M10 family) 0.026 0.4027 0.4027
Echinococcus granulosus matrix metallopeptidase 7 M10 family 0.026 0.4027 0.4027
Trichomonas vaginalis esterase, putative 0.0051 0.0255 0.0716
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.033 0.033
Schistosoma mansoni matrix metallopeptidase-9 (M10 family) 0.0048 0.0195 0.0834
Loa Loa (eye worm) hypothetical protein 0.0048 0.0206 0.0468
Brugia malayi Matrixin family protein 0.0078 0.0747 0.2909
Loa Loa (eye worm) hypothetical protein 0.0071 0.061 0.217
Plasmodium falciparum nicotinamide/nicotinic acid mononucleotide adenylyltransferase 0.0345 0.5555 1
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0051 0.0255 0.046
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0051 0.0255 0.046
Onchocerca volvulus Matrilysin homolog 0.0078 0.0747 0.2221
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0051 0.0255 0.1092
Onchocerca volvulus Matrix metalloproteinase homolog 0.0174 0.247 1
Brugia malayi Hemopexin family protein 0.0086 0.0889 0.3542
Loa Loa (eye worm) hypothetical protein 0.0051 0.0255 0.0676
Loa Loa (eye worm) hypothetical protein 0.0078 0.0747 0.2746
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0051 0.0255 0.0676
Echinococcus granulosus beta LACTamase domain containing family member 0.0051 0.0255 0.0255
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0327 0.5229 0.9413
Mycobacterium ulcerans hydrolase 0.0095 0.1056 0.19
Plasmodium vivax serine-repeat antigen 4 (SERA) 0.005 0.0234 0.0255
Onchocerca volvulus Matrilysin homolog 0.0174 0.247 1
Loa Loa (eye worm) hypothetical protein 0.0078 0.0747 0.2746
Brugia malayi Matrixin family protein 0.0078 0.0747 0.2909
Leishmania major basic transcription factor 3a, putative 0.0042 0.0095 0.3714

Activities

Activity type Activity value Assay description Source Reference
EC50 (functional) = 2.058 um PUBCHEM_BIOASSAY: Luminescence Microorganism-Based Dose Confirmation HTS to Identify Inhibitors of Streptokinase Promotor Activity. (Class of assay: confirmatory) [Related pubchem assays: 1677 (Project Summary), 1662 (Primary HTS)] ChEMBL. No reference
EC50 (functional) > 150 um PUBCHEM_BIOASSAY: Absorbance Microorganism-Based Dose Response HTS to Identify Inhibitors of Streptokinase Expression. (Class of assay: confirmatory) [Related pubchem assays: 1677 (Project Summary), 1902 (Retest at Dose), 1900 (Counter Screen), 1662 (Primary HTS)] ChEMBL. No reference
IC50 (functional) 7.71 uM PubChem BioAssay. Dose response confirmation of uHTS inhibitor hits from NadD in a Colorimetric assay. (Class of assay: confirmatory) ChEMBL. No reference
IC50 (functional) 27.4 uM PubChem BioAssay. Dose response confirmation of uHTS inhibitor hits from NadD in a Colorimetric assay - Set 2. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 3.5481 uM PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 19.9526 uM PubChem BioAssay. qHTS for Antagonists of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 22.3872 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) 23.1093 uM PubChem BioAssay. qHTS for induction of synthetic lethality in tumor cells producing 2HG: qHTS for the HT-1080-NT fibrosarcoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 23.7781 uM PubChem BioAssay. qHTS for Inhibitors of PLK1-PDB (polo-like kinase 1 - polo-box domain): Primary Screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 28.1838 uM PUBCHEM_BIOASSAY: Inhibitors of the vitamin D receptor (VDR): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504855] ChEMBL. No reference
Potency (functional) 28.1838 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) 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 for Inhibitors of Glutaminase (GLS). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 44.6684 uM PubChem BioAssay. qHTS Assay to Find Inhibitors of Pin1. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 79.4328 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Eta. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588636] 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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