Detailed information for compound 1513557

Basic information

Technical information
  • TDR Targets ID: 1513557
  • Name: 4-chloro-N-(8-methyl-8-azabicyclo[3.2.1]oct-3 -en-3-yl)-N-phenylbenzamide hydrochloride
  • MW: 389.318 | Formula: C21H22Cl2N2O
  • H donors: 0 H acceptors: 1 LogP: 5.27 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1ccc(cc1)C(=O)N(C1=CC2N(C(C1)CC2)C)c1ccccc1.Cl
  • InChi: 1S/C21H21ClN2O.ClH/c1-23-18-11-12-19(23)14-20(13-18)24(17-5-3-2-4-6-17)21(25)15-7-9-16(22)10-8-15;/h2-10,13,18-19H,11-12,14H2,1H3;1H
  • InChiKey: MXGZDBNXMRMYKA-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 4-chloro-N-(8-methyl-8-azabicyclo[3.2.1]oct-3-en-3-yl)-N-phenylbenzamide; hydron; chloride
  • 4-chloro-N-(8-methyl-8-azabicyclo[3.2.1]oct-3-en-3-yl)-N-phenyl-benzamide hydrochloride
  • 4-chloro-N-(8-methyl-8-azabicyclo[3.2.1]oct-3-en-3-yl)-N-phenyl-benzamide; hydron; chloride
  • 4-Chloro-N-(8-methyl-8-aza-bicyclo[3.2.1]oct-2-en-3-yl)-N-phenyl-benzamide
  • MLS000029693
  • SMR000009907

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens geminin, DNA replication inhibitor Starlite/ChEMBL No references
Homo sapiens glucagon-like peptide 1 receptor Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi Hypothetical 65.5 kDa Trp-Asp repeats containing protein F02E8.5 inchromosome X geminin, DNA replication inhibitor 209 aa 176 aa 27.8 %
Loa Loa (eye worm) pigment dispersing factor receptor c glucagon-like peptide 1 receptor 463 aa 388 aa 25.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) hypothetical protein 0.0061 0.0118 0.0118
Schistosoma mansoni biotin-protein ligase 0.0178 0.0446 0.0446
Brugia malayi Sema domain containing protein 0.0053 0.0095 0.0095
Brugia malayi Protein kinase domain containing protein 0.0025 0.0015 0.0015
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.0036 0.0048 0.0048
Leishmania major hypothetical protein, conserved 0.0433 0.1159 1
Entamoeba histolytica PH domain containing protein kinase, putative 0.0025 0.0015 0.0289
Trichomonas vaginalis AGC family protein kinase 0.0025 0.0015 0.0289
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.0115 0.0115
Brugia malayi Immunoglobulin I-set domain containing protein 0.0023 0.0012 0.0012
Echinococcus granulosus fatty acid amide hydrolase 1 0.0433 0.1159 0.1159
Loa Loa (eye worm) hypothetical protein 0.0208 0.053 0.053
Mycobacterium tuberculosis Probable amidase AmiD (acylamidase) (acylase) 0.0433 0.1159 1
Echinococcus multilocularis N terminal of biotin protein ligase 0.0162 0.04 0.04
Entamoeba histolytica hypothetical protein 0.0023 0.0011 0.0216
Loa Loa (eye worm) hypothetical protein 0.0053 0.0095 0.0095
Trichomonas vaginalis conserved hypothetical protein 0.0208 0.053 1
Entamoeba histolytica protein kinase , putative 0.0062 0.012 0.2259
Loa Loa (eye worm) hypothetical protein 0.0208 0.053 0.053
Mycobacterium ulcerans amidase 0.0433 0.1159 1
Schistosoma mansoni serine/threonine protein kinase 0.0985 0.2704 0.2704
Echinococcus multilocularis A kinase anchor protein 10, mitochondrial 0.0208 0.053 0.053
Loa Loa (eye worm) PXA domain-containing protein 0.0208 0.053 0.053
Echinococcus multilocularis aurora kinase A 0.0062 0.012 0.012
Echinococcus granulosus plexin a4 0.0137 0.0331 0.0331
Mycobacterium tuberculosis Probable amidase AmiC (aminohydrolase) 0.0433 0.1159 1
Schistosoma mansoni regulator of G protein signaling 0.0208 0.053 0.053
Trypanosoma cruzi rac serine-threonine kinase, putative 0.0025 0.0015 0.0132
Schistosoma mansoni z-protein (S1r protein) 0.0208 0.053 0.053
Entamoeba histolytica protein kinase, putative 0.0025 0.0015 0.0289
Trypanosoma brucei serine/threonine-protein kinase NrkA 0.0025 0.0015 0.0132
Trichomonas vaginalis conserved hypothetical protein 0.0023 0.0011 0.0216
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.0036 0.0048 0.0048
Entamoeba histolytica cell surface protease gp63, putative 0.0023 0.0011 0.0216
Brugia malayi hypothetical protein 0.0208 0.053 0.053
Loa Loa (eye worm) AUR protein kinase 0.0062 0.012 0.012
Plasmodium falciparum serine/threonine protein kinase, putative 0.0062 0.012 0.1032
Mycobacterium leprae PROBABLE GLUTAMYL-TRNA(GLN) AMIDOTRANSFERASE (SUBUNIT A) GATA (Glu-ADT SUBUNIT A) 0.0433 0.1159 1
Schistosoma mansoni regulator of G protein signaling 3 rgs3 0.0208 0.053 0.053
Brugia malayi Sema domain containing protein 0.0053 0.0095 0.0095
Trypanosoma brucei NEK family Serine/threonine-protein kinase, putative 0.0025 0.0015 0.0132
Schistosoma mansoni voltage-gated potassium channel 0.004 0.0057 0.0057
Trichomonas vaginalis AGC family protein kinase 0.0062 0.012 0.2259
Entamoeba histolytica protein kinase, putative 0.0025 0.0015 0.0289
Schistosoma mansoni protein kinase 0.0062 0.012 0.012
Giardia lamblia Hypothetical protein 0.0178 0.0446 1
Trichomonas vaginalis AGC family protein kinase 0.0062 0.012 0.2259
Entamoeba histolytica protein kinase, putative 0.0025 0.0015 0.0289
Brugia malayi Probable G protein-coupled receptor kinase F19C6.1, putative 0.1076 0.2961 0.2961
Plasmodium falciparum glutamyl-tRNA(Gln) amidotransferase subunit A 0.0433 0.1159 1
Entamoeba histolytica tyrosin kinase, putative 0.0031 0.0033 0.0619
Echinococcus multilocularis regulator of G protein signaling 3 0.0208 0.053 0.053
Leishmania major folate/biopterin transporter, putative 0.0025 0.0015 0.0132
Trypanosoma cruzi Serine/threonine-protein kinase NEK21, putative 0.0025 0.0015 0.0132
Echinococcus granulosus glutamyl tRNAGln amidotransferase subunit A 0.0433 0.1159 0.1159
Entamoeba histolytica hypothetical protein 0.0025 0.0015 0.0289
Echinococcus granulosus 5'partial|biotin protein ligase 0.0162 0.04 0.04
Schistosoma mansoni hypothetical protein 0.0023 0.0011 0.0011
Entamoeba histolytica hypothetical protein, conserved 0.0162 0.04 0.7555
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0034 0.0041 0.0782
Trichomonas vaginalis AGC family protein kinase 0.0025 0.0015 0.0289
Trypanosoma cruzi Serine/threonine-protein kinase NEK17, putative 0.0025 0.0015 0.0132
Brugia malayi hypothetical protein 0.0053 0.0095 0.0095
Echinococcus multilocularis exocyst complex component 2 0.0023 0.0011 0.0011
Brugia malayi hypothetical protein 0.0053 0.0095 0.0095
Brugia malayi Regulator of G protein signaling domain containing protein 0.0208 0.053 0.053
Trichomonas vaginalis AGC family protein kinase 0.0025 0.0015 0.0289
Plasmodium falciparum biotin--acetyl-CoA-carboxylase, putative 0.0178 0.0446 0.3852
Trichomonas vaginalis AGC family protein kinase 0.0025 0.0015 0.0289
Echinococcus granulosus serine/threonine protein kinase 0.0025 0.0015 0.0015
Brugia malayi hypothetical protein 0.0208 0.053 0.053
Brugia malayi putative amidase 0.0433 0.1159 0.1159
Trypanosoma cruzi serine/threonine protein kinase, putative 0.0025 0.0015 0.0132
Entamoeba histolytica hypothetical protein, conserved 0.0162 0.04 0.7555
Toxoplasma gondii protein kinase domain-containing protein 0.0025 0.0015 0.1281
Onchocerca volvulus 0.0114 0.0266 1
Schistosoma mansoni biotin-protein ligase 0.0162 0.04 0.04
Trypanosoma cruzi NIMA-related kinase, putative 0.0025 0.0015 0.0132
Plasmodium falciparum calcium-dependent protein kinase 7 0.0025 0.0015 0.0132
Loa Loa (eye worm) sema domain-containing protein 0.0053 0.0095 0.0095
Schistosoma mansoni fibrocystin l 0.0023 0.0011 0.0011
Mycobacterium ulcerans amidase 0.0433 0.1159 1
Loa Loa (eye worm) hypothetical protein 0.0031 0.0035 0.0035
Entamoeba histolytica protein kinase domain containing protein 0.0062 0.012 0.2259
Loa Loa (eye worm) AGC/GRK/GRK protein kinase 0.1284 0.3544 0.3544
Loa Loa (eye worm) hypothetical protein 0.0208 0.053 0.053
Schistosoma mansoni hypothetical protein 0.0053 0.0095 0.0095
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.0115 0.0115
Trypanosoma cruzi Biotin--acetyl-CoA-carboxylase ligase, putative 0.0178 0.0446 0.3852
Entamoeba histolytica hypothetical protein, conserved 0.0162 0.04 0.7555
Mycobacterium tuberculosis Probable amidase AmiB2 (aminohydrolase) 0.0433 0.1159 1
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0036 0.0048 0.0048
Onchocerca volvulus 0.0053 0.0095 0.3564
Brugia malayi Regulator of G protein signaling domain containing protein 0.0208 0.053 0.053
Echinococcus granulosus regulator of G protein signaling 3 0.0208 0.053 0.053
Entamoeba histolytica hypothetical protein 0.0023 0.0011 0.0216
Trypanosoma cruzi Biotin--acetyl-CoA-carboxylase ligase, putative 0.0178 0.0446 0.3852
Brugia malayi Plexin repeat family protein 0.0114 0.0266 0.0266
Echinococcus multilocularis regulator of G protein signaling 0.0208 0.053 0.053
Echinococcus multilocularis Regulator of G protein signaling 20 0.0208 0.053 0.053
Schistosoma mansoni hypothetical protein 0.0205 0.052 0.052
Schistosoma mansoni fatty-acid amide hydrolase 0.0433 0.1159 0.1159
Loa Loa (eye worm) AGC/GRK/BARK protein kinase 0.0985 0.2704 0.2704
Entamoeba histolytica hypothetical protein 0.0023 0.0011 0.0216
Loa Loa (eye worm) TK/KIN16 protein kinase 0.0023 0.0012 0.0012
Mycobacterium ulcerans amidase 0.0433 0.1159 1
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0034 0.0041 0.0782
Echinococcus granulosus regulator of G protein signaling 7 0.0208 0.053 0.053
Trypanosoma cruzi serine/threonine-protein kinase NRKB, putative 0.0025 0.0015 0.0132
Brugia malayi IPT/TIG domain containing protein 0.0023 0.0011 0.0011
Trichomonas vaginalis ribosomal protein S6 kinase, 90kD, polypeptide, putative 0.0025 0.0015 0.0289
Mycobacterium ulcerans amidase 0.0433 0.1159 1
Trichomonas vaginalis AGC family protein kinase 0.0025 0.0015 0.0289
Trypanosoma brucei fatty-acid amide hydrolase, putative 0.0433 0.1159 1
Trichomonas vaginalis AGC family protein kinase 0.0025 0.0015 0.0289
Trichomonas vaginalis AGC family protein kinase 0.0025 0.0015 0.0289
Echinococcus granulosus A kinase anchor protein 10 mitochondrial 0.0208 0.053 0.053
Trichomonas vaginalis AGC family protein kinase 0.0025 0.0015 0.0289
Mycobacterium ulcerans aspartyl/glutamyl-tRNA amidotransferase subunit A 0.0433 0.1159 1
Echinococcus multilocularis semaphorin 5B 0.0053 0.0095 0.0095
Schistosoma mansoni serine/threonine protein kinase 0.1284 0.3544 0.3544
Brugia malayi regulator of G-protein signaling rgs-7 0.0208 0.053 0.053
Plasmodium vivax calcium-dependent protein kinase 7, putative 0.0025 0.0015 0.0132
Echinococcus multilocularis regulator of G protein signaling 7 0.0208 0.053 0.053
Trichomonas vaginalis AGC family protein kinase 0.0025 0.0015 0.0289
Entamoeba histolytica protein kinase domain containing protein 0.0031 0.0033 0.0619
Loa Loa (eye worm) hypothetical protein 0.0053 0.0095 0.0095
Echinococcus multilocularis transcription factor collier 0.0023 0.0011 0.0011
Loa Loa (eye worm) hypothetical protein 0.0208 0.053 0.053
Entamoeba histolytica hypothetical protein, conserved 0.0162 0.04 0.7555
Brugia malayi biotin--acetyl-CoA-carboxylase ligase family protein 0.0178 0.0446 0.0446
Loa Loa (eye worm) hypothetical protein 0.0023 0.0011 0.0011
Echinococcus granulosus aurora kinase A 0.0062 0.012 0.012
Trichomonas vaginalis AGC family protein kinase 0.0025 0.0015 0.0289
Echinococcus granulosus expressed protein 0.0208 0.053 0.053
Leishmania major protein kinase, putative,serine/threonine protein kinase, putative 0.0025 0.0015 0.0132
Echinococcus granulosus semaphorin 5B 0.0053 0.0095 0.0095
Entamoeba histolytica hypothetical protein 0.0208 0.053 1
Schistosoma mansoni regulator of G protein signaling 0.0208 0.053 0.053
Echinococcus multilocularis biotin protein ligase 0.0178 0.0446 0.0446
Schistosoma mansoni hypothetical protein 0.0205 0.052 0.052
Mycobacterium leprae PROBABLE AMIDASE AMIC (AMINOHYDROLASE) 0.0433 0.1159 1
Trichomonas vaginalis regulator of G protein signaling 5, rgs5, putative 0.0208 0.053 1
Leishmania major protein kinase, putative 0.0025 0.0015 0.0132
Mycobacterium tuberculosis Probable amidase AmiA2 (aminohydrolase) 0.0433 0.1159 1
Echinococcus multilocularis G protein coupled receptor kinase 1 0.0776 0.2121 0.2121
Trichomonas vaginalis conserved hypothetical protein 0.0023 0.0011 0.0216
Loa Loa (eye worm) hypothetical protein 0.0162 0.04 0.04
Loa Loa (eye worm) G protein signaling regulator EGL-10 0.0208 0.053 0.053
Entamoeba histolytica PH domain containing protein kinase, putative 0.0025 0.0015 0.0289
Echinococcus granulosus [G-protein-coupledreceptor] kinase 0.1076 0.2961 0.2961
Trichomonas vaginalis Clan MA, family M8, leishmanolysin-like metallopeptidase 0.0023 0.0011 0.0216
Trichomonas vaginalis AGC family protein kinase 0.0025 0.0015 0.0289
Brugia malayi serine/threonine protein kinase 6 0.0062 0.012 0.012
Entamoeba histolytica protein kinase, putative 0.0025 0.0015 0.0289
Schistosoma mansoni hypothetical protein 0.0061 0.0118 0.0118
Echinococcus granulosus G protein coupled receptor kinase 1 0.0776 0.2121 0.2121
Trypanosoma cruzi Serine/threonine-protein kinase NEK21, putative 0.0025 0.0015 0.0132
Trichomonas vaginalis AGC family protein kinase 0.0025 0.0015 0.0289
Echinococcus granulosus axis inhibition protein axin 0.0208 0.053 0.053
Trichomonas vaginalis AGC family protein kinase 0.0025 0.0015 0.0289
Schistosoma mansoni serine/threonine-protein kinase 0.0025 0.0015 0.0015
Trichomonas vaginalis AGC family protein kinase 0.0025 0.0015 0.0289
Entamoeba histolytica hypothetical protein 0.0208 0.053 1
Brugia malayi Probable G protein-coupled receptor kinase F19C6.1, putative 0.1284 0.3544 0.3544
Trichomonas vaginalis conserved hypothetical protein 0.0208 0.053 1
Loa Loa (eye worm) hypothetical protein 0.0053 0.0095 0.0095
Schistosoma mansoni semaphorin 5-related 0.0053 0.0095 0.0095
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0036 0.0048 0.0048
Echinococcus multilocularis hypothetical protein 0.0053 0.0095 0.0095
Trichomonas vaginalis Clan MA, family M8, leishmanolysin-like metallopeptidase 0.0023 0.0011 0.0216
Echinococcus granulosus regulator of G protein signaling 3 0.0208 0.053 0.053
Loa Loa (eye worm) AGC/AKT protein kinase 0.0025 0.0015 0.0015
Echinococcus multilocularis plexin a4 0.0137 0.0331 0.0331
Trypanosoma cruzi Protein kinase B 0.0025 0.0015 0.0132
Entamoeba histolytica protein kinase, putative 0.0025 0.0015 0.0289
Loa Loa (eye worm) hypothetical protein 0.0114 0.0266 0.0266
Echinococcus multilocularis expressed protein 0.0208 0.053 0.053
Schistosoma mansoni voltage-gated potassium channel 0.004 0.0057 0.0057
Entamoeba histolytica serine/threonine protein kinase 6, putative 0.0062 0.012 0.2259
Trichomonas vaginalis conserved hypothetical protein 0.0023 0.0011 0.0216
Entamoeba histolytica protein kinase, putative 0.0025 0.0015 0.0289
Mycobacterium ulcerans peptide amidase, GatA 0.0433 0.1159 1
Brugia malayi plexin A 0.0137 0.0331 0.0331
Trypanosoma cruzi amidase, putative 0.0433 0.1159 1
Leishmania major serine/threonine-protein kinase a, putative 0.0025 0.0015 0.0132
Loa Loa (eye worm) AUR protein kinase 0.0062 0.012 0.012
Schistosoma mansoni regulator of G protein signaling 0.0208 0.053 0.053
Entamoeba histolytica hypothetical protein 0.0208 0.053 1
Echinococcus granulosus Regulator of G protein signaling 20 0.0208 0.053 0.053
Trichomonas vaginalis AGC family protein kinase 0.0025 0.0015 0.0289
Trypanosoma cruzi NIMA-related kinase, putative 0.0025 0.0015 0.0132
Chlamydia trachomatis glutamyl-tRNA(Gln) amidotransferase subunit A 0.0433 0.1159 1
Trichomonas vaginalis AGC family protein kinase 0.0025 0.0015 0.0289
Loa Loa (eye worm) amidase 0.0433 0.1159 0.1159
Trichomonas vaginalis AGC family protein kinase 0.0025 0.0015 0.0289
Schistosoma mansoni regulator of G protein signaling 17 19 20 (rgs17 19 20) 0.0208 0.053 0.053
Loa Loa (eye worm) AUR protein kinase 0.0062 0.012 0.012
Entamoeba histolytica hypothetical protein, conserved 0.0162 0.04 0.7555
Brugia malayi A-kinase anchor protein 10, precursor 0.0208 0.053 0.053
Echinococcus multilocularis rac serine:threonine kinase 0.0025 0.0015 0.0015
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.0062 0.0062
Entamoeba histolytica protein kinase, putative 0.0062 0.012 0.2259
Brugia malayi Amidase family protein 0.0433 0.1159 0.1159
Entamoeba histolytica serine/threonine- protein kinase 6, putative 0.0062 0.012 0.2259
Schistosoma mansoni plexin 0.0061 0.0118 0.0118
Leishmania major protein kinase, putative 0.0025 0.0015 0.0132
Loa Loa (eye worm) hypothetical protein 0.0023 0.0011 0.0011
Echinococcus multilocularis fatty acid amide hydrolase 1 0.0433 0.1159 0.1159
Trichomonas vaginalis Clan MA, family M8, leishmanolysin-like metallopeptidase 0.0023 0.0011 0.0216
Schistosoma mansoni hypothetical protein 0.0023 0.0011 0.0011
Trypanosoma brucei Serine/threonine-protein kinase NEK21, putative 0.0025 0.0015 0.0132
Echinococcus granulosus axis inhibition protein axin 0.0208 0.053 0.053
Trichomonas vaginalis conserved hypothetical protein 0.0208 0.053 1
Loa Loa (eye worm) amidase 0.0433 0.1159 0.1159
Trichomonas vaginalis AGC family protein kinase 0.0025 0.0015 0.0289
Schistosoma mansoni axis inhibition protein axin 0.0208 0.053 0.053
Trichomonas vaginalis AGC family protein kinase 0.0025 0.0015 0.0289
Echinococcus multilocularis geminin 0.0205 0.052 0.052
Echinococcus granulosus geminin 0.0205 0.052 0.052
Trypanosoma cruzi amidase, putative 0.0433 0.1159 1
Loa Loa (eye worm) sema domain-containing protein 0.0053 0.0095 0.0095
Schistosoma mansoni hypothetical protein 0.0041 0.0062 0.0062
Echinococcus granulosus serine:threonine protein kinase 12 B 0.0062 0.012 0.012
Echinococcus granulosus N terminal of biotin protein ligase 0.0162 0.04 0.04
Treponema pallidum aspartyl/glutamyl-tRNA amidotransferase subunit A 0.0433 0.1159 1
Mycobacterium ulcerans amidase 0.0433 0.1159 1
Schistosoma mansoni regulator of G protein signaling 17 19 20 (rgs17 19 20) 0.0208 0.053 0.053
Echinococcus multilocularis biotin protein ligase 0.0178 0.0446 0.0446
Loa Loa (eye worm) hypothetical protein 0.0023 0.0011 0.0011
Trichomonas vaginalis AGC family protein kinase 0.0025 0.0015 0.0289
Entamoeba histolytica protein kinase, putative 0.0062 0.012 0.2259
Entamoeba histolytica hypothetical protein, conserved 0.0162 0.04 0.7555
Schistosoma mansoni serine/threonine protein kinase 0.0985 0.2704 0.2704
Entamoeba histolytica hypothetical protein, conserved 0.0162 0.04 0.7555
Trichomonas vaginalis AGC family protein kinase 0.0025 0.0015 0.0289
Entamoeba histolytica PH domain containing protein kinase, putative 0.0025 0.0015 0.0289
Loa Loa (eye worm) G protein-coupled receptor kinase 1 0.1076 0.2961 0.2961
Loa Loa (eye worm) AGC/GRK/GRK protein kinase 0.1076 0.2961 0.2961
Entamoeba histolytica PH domain containing protein kinase, putative 0.0025 0.0015 0.0289
Trichomonas vaginalis conserved hypothetical protein 0.0023 0.0011 0.0216
Schistosoma mansoni hypothetical protein 0.0053 0.0095 0.0095
Brugia malayi regulator of G-protein signaling egl-10 0.0208 0.053 0.053
Plasmodium falciparum biotin protein ligase, putative 0.0178 0.0446 0.3852
Trichomonas vaginalis conserved hypothetical protein 0.0023 0.0011 0.0216
Trypanosoma cruzi aurora B kinase, putative 0.0062 0.012 0.1032
Trichomonas vaginalis AGC family protein kinase 0.0025 0.0015 0.0289
Plasmodium vivax serine/threonine protein kinase 6, putative 0.0062 0.012 0.1032
Schistosoma mansoni serine/threonine protein kinase 0.0062 0.012 0.012
Trichomonas vaginalis AGC family protein kinase 0.0062 0.012 0.2259
Brugia malayi Amidase family protein 0.0433 0.1159 0.1159
Trypanosoma brucei aurora B kinase 0.0062 0.012 0.1032
Echinococcus granulosus transcription factor collier 0.0023 0.0011 0.0011
Loa Loa (eye worm) plexin A 0.0137 0.0331 0.0331
Schistosoma mansoni regulator of G protein signaling 0.0208 0.053 0.053
Brugia malayi PXA domain containing protein 0.0208 0.053 0.053
Echinococcus granulosus regulator of G protein signaling 7 0.0208 0.053 0.053
Entamoeba histolytica hypothetical protein 0.0023 0.0011 0.0216
Loa Loa (eye worm) hypothetical protein 0.0041 0.0062 0.0062
Entamoeba histolytica p21-activated kinase 0.0025 0.0015 0.0289
Entamoeba histolytica hypothetical protein, conserved 0.0162 0.04 0.7555
Trichomonas vaginalis Clan MA, family M8, leishmanolysin-like metallopeptidase 0.0023 0.0011 0.0216
Echinococcus granulosus beta-adrenergic receptor kinase 0.0985 0.2704 0.2704
Schistosoma mansoni glutamyl-tRNA(Gln) amidotransferase subunit A 0.0433 0.1159 0.1159
Entamoeba histolytica hypothetical protein 0.0025 0.0015 0.0289
Trichomonas vaginalis AGC family protein kinase 0.0062 0.012 0.2259
Brugia malayi serine/threonine-protein kinase 6 0.0062 0.012 0.012
Echinococcus granulosus semaphorin 1A 0.0053 0.0095 0.0095
Echinococcus granulosus twitchin 0.0021 0.0006 0.0006
Loa Loa (eye worm) RGS-3 protein 0.0208 0.053 0.053
Echinococcus multilocularis G protein coupled receptor kinase 6 0.1076 0.2961 0.2961
Trypanosoma cruzi NEK family Serine/threonine-protein kinase, putative 0.0025 0.0015 0.0132
Loa Loa (eye worm) biotin protein ligase 1 0.0178 0.0446 0.0446
Leishmania major rac serine-threonine kinase, putative,protein kinase, putative 0.0025 0.0015 0.0132
Entamoeba histolytica serine/threonine- protein kinase 6 , putative 0.0062 0.012 0.2259
Entamoeba histolytica biotin--acetyl-CoA-carboxylase ligase, putative 0.0178 0.0446 0.8429
Entamoeba histolytica PH domain containing protein kinase, putative 0.0025 0.0015 0.0289
Trichomonas vaginalis Clan MA, family M8, leishmanolysin-like metallopeptidase 0.0023 0.0011 0.0216
Loa Loa (eye worm) hypothetical protein 0.0162 0.04 0.04
Echinococcus granulosus exocyst complex component 2 0.0023 0.0011 0.0011
Loa Loa (eye worm) hypothetical protein 0.0208 0.053 0.053
Trichomonas vaginalis conserved hypothetical protein 0.0023 0.0011 0.0216
Brugia malayi serine/threonine kinase 12 0.0062 0.012 0.012
Loa Loa (eye worm) hypothetical protein 0.0053 0.0095 0.0095
Trichomonas vaginalis AGC family protein kinase 0.0025 0.0015 0.0289
Trypanosoma cruzi Serine/threonine-protein kinase NEK17, putative 0.0025 0.0015 0.0132
Loa Loa (eye worm) hypothetical protein 0.0053 0.0095 0.0095
Trypanosoma brucei rac serine-threonine kinase, putative 0.0025 0.0015 0.0132
Trichomonas vaginalis conserved hypothetical protein 0.0208 0.053 1
Echinococcus multilocularis serine:threonine protein kinase 12 B 0.0062 0.012 0.012
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.0115 0.0115
Toxoplasma gondii aurora kinase 0.0062 0.012 1
Trichomonas vaginalis AGC family protein kinase 0.0025 0.0015 0.0289
Loa Loa (eye worm) hypothetical protein 0.006 0.0115 0.0115
Trypanosoma cruzi rac serine-threonine kinase, putative 0.0025 0.0015 0.0132
Trypanosoma brucei protein kinase, putative 0.0025 0.0015 0.0132
Toxoplasma gondii calcium dependent protein kinase CDPK7 0.0025 0.0015 0.1281
Leishmania major biotin/lipoate protein ligase-like protein 0.0178 0.0446 0.3852
Loa Loa (eye worm) hypothetical protein 0.0053 0.0095 0.0095
Trichomonas vaginalis conserved hypothetical protein 0.0023 0.0011 0.0216
Echinococcus multilocularis axis inhibition protein axin 0.0208 0.053 0.053
Trichomonas vaginalis AGC family protein kinase 0.0025 0.0015 0.0289
Echinococcus multilocularis glutamyl tRNA(Gln) amidotransferase subunit A 0.0433 0.1159 0.1159
Echinococcus multilocularis regulator of G protein signaling 3 0.0208 0.053 0.053
Trichomonas vaginalis 3-phosphoinositide dependent protein kinase-1, putative 0.0025 0.0015 0.0289
Trichomonas vaginalis AGC family protein kinase 0.0025 0.0015 0.0289
Entamoeba histolytica PH domain containing protein kinase, putative 0.0025 0.0015 0.0289
Trypanosoma brucei serine/threonine-protein kinase NRKB, putative 0.0025 0.0015 0.0132
Schistosoma mansoni plexin 0.0114 0.0266 0.0266
Echinococcus multilocularis regulator of G protein signaling 7 0.0208 0.053 0.053
Leishmania major protein kinase, putative 0.0062 0.012 0.1032
Trypanosoma brucei Biotin--acetyl-CoA-carboxylase ligase, putative 0.0178 0.0446 0.3852
Loa Loa (eye worm) hypothetical protein 0.0023 0.0011 0.0011
Schistosoma mansoni serine/threonine-protein kinase 0.0025 0.0015 0.0015
Brugia malayi DNA-binding protein LAG-1 0.0023 0.0011 0.0011
Schistosoma mansoni regulator of G protein signaling 0.0208 0.053 0.053
Brugia malayi PXA domain containing protein 0.0208 0.053 0.053
Echinococcus multilocularis axis inhibition protein axin 0.0208 0.053 0.053
Trichomonas vaginalis AGC family protein kinase 0.0025 0.0015 0.0289
Wolbachia endosymbiont of Brugia malayi aspartyl/glutamyl-tRNA amidotransferase subunit A 0.0433 0.1159 1
Echinococcus multilocularis beta adrenergic receptor kinase 0.0985 0.2704 0.2704
Schistosoma mansoni axis inhibition protein axin 0.0208 0.053 0.053
Plasmodium vivax biotin--[acetyl-CoA-carboxylase] synthetase, putative 0.0178 0.0446 0.3852
Trichomonas vaginalis AGC family protein kinase 0.0025 0.0015 0.0289
Loa Loa (eye worm) hypothetical protein 0.0208 0.053 0.053
Plasmodium vivax glutamyl-tRNA(Gln) amidotransferase subunit A, putative 0.0433 0.1159 1
Entamoeba histolytica hypothetical protein, conserved 0.0162 0.04 0.7555
Mycobacterium tuberculosis Possible amidase (aminohydrolase) 0.0433 0.1159 1
Trichomonas vaginalis conserved hypothetical protein 0.0208 0.053 1
Trichomonas vaginalis conserved hypothetical protein 0.0208 0.053 1
Brugia malayi Probable exocyst complex component Sec5 0.0023 0.0011 0.0011
Chlamydia trachomatis biotin synthetase 0.0178 0.0446 0.061
Entamoeba histolytica protein kinase, putative 0.0025 0.0015 0.0289

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 11.2202 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 18.3564 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in MCF 10a normal breast cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 50.1187 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) 89.1251 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] 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.

If you have references for this compound, please enter them in a user comment (below) or Contact us.