Detailed information for compound 1419697

Basic information

Technical information
  • TDR Targets ID: 1419697
  • Name: N-[2-[[2-(cyclopentylamino)-2-oxo-1-pyridin-4 -ylethyl]-(3-methylphenyl)amino]-2-oxoethyl]t hiophene-2-carboxamide
  • MW: 476.591 | Formula: C26H28N4O3S
  • H donors: 2 H acceptors: 4 LogP: 3.9 Rotable bonds: 11
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(C(N(c1cccc(c1)C)C(=O)CNC(=O)c1cccs1)c1ccncc1)NC1CCCC1
  • InChi: 1S/C26H28N4O3S/c1-18-6-4-9-21(16-18)30(23(31)17-28-25(32)22-10-5-15-34-22)24(19-11-13-27-14-12-19)26(33)29-20-7-2-3-8-20/h4-6,9-16,20,24H,2-3,7-8,17H2,1H3,(H,28,32)(H,29,33)
  • InChiKey: YWEIDYLQALPESC-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-[2-[[2-(cyclopentylamino)-2-oxo-1-(4-pyridyl)ethyl]-(3-methylphenyl)amino]-2-oxo-ethyl]thiophene-2-carboxamide
  • N-[2-[[2-(cyclopentylamino)-2-oxo-1-(4-pyridyl)ethyl]-(3-methylphenyl)amino]-2-oxoethyl]-2-thiophenecarboxamide
  • N-[2-[[2-(cyclopentylamino)-2-keto-1-(4-pyridyl)ethyl]-(3-methylphenyl)amino]-2-keto-ethyl]thiophene-2-carboxamide
  • N-[2-[[2-(cyclopentylamino)-2-oxo-1-pyridin-4-yl-ethyl]-(3-methylphenyl)amino]-2-oxo-ethyl]thiophene-2-carboxamide
  • ASN 05581840

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens GNAS complex locus Starlite/ChEMBL No references
Escherichia coli penicillin-binding protein Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
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
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
Mycobacterium tuberculosis Possible penicillin-binding protein Get druggable targets OG5_149948 All targets in OG5_149948
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
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
Echinococcus multilocularis guanine nucleotide binding protein G(s) 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
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
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
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 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
Schistosoma mansoni GTP-binding protein alpha subunit gna GNAS complex locus 394 aa 450 aa 28.7 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0114 0.2467 0.2085
Echinococcus multilocularis ATP binding cassette sub family B 0.0122 0.2698 0.2328
Schistosoma mansoni multidrug resistance protein 0.0122 0.2698 0.2503
Loa Loa (eye worm) hypothetical protein 0.0043 0.0482 0.0482
Plasmodium falciparum multidrug resistance-associated protein 2 0.0122 0.2698 0.2698
Schistosoma mansoni ABC transporter 0.0303 0.7787 0.7727
Plasmodium vivax ABC transporter B family member 6, putative 0.0122 0.2698 0.2698
Echinococcus granulosus multidrug resistance associated protein 7 0.0122 0.2698 0.2328
Trichomonas vaginalis ABC transporter, half transporter, putative 0.0381 1 1
Plasmodium falciparum ABC transporter B family member 4, putative 0.0122 0.2698 0.2698
Wolbachia endosymbiont of Brugia malayi ABC-type protease secretion system, ATPase and permease component, AprD 0.0122 0.2698 0.5
Plasmodium falciparum ABC transporter B family member 3, putative 0.0122 0.2698 0.2698
Echinococcus multilocularis ATP binding cassette sub family B 0.0122 0.2698 0.2328
Plasmodium vivax ABC transporter B family member 7, putative 0.0122 0.2698 0.2698
Brugia malayi beta-lactamase 0.0043 0.0482 0.0482
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0122 0.2698 0.2515
Giardia lamblia ABC transporter 0.0348 0.9063 1
Echinococcus multilocularis ATP binding cassette sub family B 0.0122 0.2698 0.2328
Mycobacterium ulcerans drugs-transport transmembrane ATP-binding protein ABC transporter 0.0122 0.2698 0.2515
Plasmodium vivax multidrug resistance-associated protein 2, putative 0.0122 0.2698 0.2698
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0043 0.0482 0.0482
Schistosoma mansoni multidrug resistance protein 0.0122 0.2698 0.2503
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0381 1 1
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0381 1 1
Leishmania major hypothetical protein, conserved 0.0043 0.0482 0.0482
Mycobacterium ulcerans daunorubicin-DIM-transport integral membrane protein ABC transporter DrrB 0.0054 0.0766 0.0322
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0381 1 1
Loa Loa (eye worm) ABC transporter 0.0303 0.7787 0.7787
Echinococcus multilocularis ATP binding cassette sub family B 0.0373 0.9768 0.9756
Leishmania major ATP-binding cassette protein subfamily G, member 5, putative 0.0062 0.0998 0.0998
Entamoeba histolytica ATP-binding cassette protein, putative 0.0122 0.2698 0.2093
Trypanosoma brucei ABC transporter, mitochondrial, putative 0.0122 0.2698 0.2903
Chlamydia trachomatis ABC transporter ATP binding protein/permease 0.0381 1 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0813 0.0567
Loa Loa (eye worm) hypothetical protein 0.0122 0.2698 0.2698
Trypanosoma brucei multidrug resistance protein E 0.0122 0.2698 0.2903
Entamoeba histolytica P-glycoprotein-2, putative 0.0381 1 1
Loa Loa (eye worm) RNA binding protein 0.0066 0.1123 0.1123
Trichomonas vaginalis conserved hypothetical protein 0.0114 0.2467 0.2085
Schistosoma mansoni tar DNA-binding protein 0.0066 0.1123 0.0885
Plasmodium vivax ABC transporter B family member 5, putative 0.0122 0.2698 0.2698
Trichomonas vaginalis ABC transporter, putative 0.0381 1 1
Leishmania major ATP-binding cassette protein subfamily G, member 6, putative 0.0356 0.9295 0.9295
Trypanosoma cruzi ABC transporter, putative 0.0054 0.0766 0.0824
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0381 1 1
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0066 0.1123 0.1123
Entamoeba histolytica P-glycoprotein 5, putative 0.0114 0.2467 0.1842
Trypanosoma cruzi multidrug resistance-associated protein, putative 0.0122 0.2698 0.2903
Brugia malayi multidrug Resistance Protein family member (mrp-5), putative 0.0122 0.2698 0.2698
Leishmania major ATP-binding cassette protein subfamily C, member 2, putative 0.0122 0.2698 0.2698
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0381 1 1
Leishmania major ATP-binding cassette protein subfamily B, member 1, putative 0.0122 0.2698 0.2698
Schistosoma mansoni smdr1 0.0122 0.2698 0.2503
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0381 1 1
Brugia malayi TAR-binding protein 0.0066 0.1123 0.1123
Echinococcus granulosus ATP binding cassette sub family B 0.0114 0.2467 0.2085
Entamoeba histolytica P-glycoprotein-1 0.0381 1 1
Mycobacterium leprae Probable lipopolysaccharide transport integral membrane ABC transporter RfbD 0.0054 0.0766 0.128
Loa Loa (eye worm) hypothetical protein 0.0381 1 1
Mycobacterium tuberculosis Probable transmembrane multidrug efflux pump 0.0381 1 1
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0381 1 1
Plasmodium falciparum ABC transporter G family member 2 0.0356 0.9295 0.9295
Toxoplasma gondii ATP-binding cassette G family transporter ABCG84 0.0356 0.9295 0.9295
Loa Loa (eye worm) hypothetical protein 0.0054 0.0766 0.0766
Loa Loa (eye worm) hypothetical protein 0.0122 0.2698 0.2698
Echinococcus granulosus tar DNA binding protein 0.0066 0.1123 0.0673
Loa Loa (eye worm) ABC transporter 0.0122 0.2698 0.2698
Trypanosoma cruzi ABC transporter, mitochondrial, putative 0.0122 0.2698 0.2903
Trichomonas vaginalis abcb9, putative 0.0381 1 1
Loa Loa (eye worm) hypothetical protein 0.0054 0.0766 0.0766
Trichomonas vaginalis ABC transporter, putative 0.0381 1 1
Schistosoma mansoni smdr2 0.0381 1 1
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0122 0.2698 0.2515
Giardia lamblia Multidrug resistance-associated protein 1 0.0122 0.2698 0.0351
Loa Loa (eye worm) hypothetical protein 0.0036 0.0261 0.0261
Echinococcus multilocularis tar DNA binding protein 0.0066 0.1123 0.0673
Trichomonas vaginalis ABC transporter, putative 0.0381 1 1
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0381 1 1
Onchocerca volvulus 0.0381 1 1
Plasmodium vivax ABC transporter B family member 3, putative 0.0122 0.2698 0.2698
Loa Loa (eye worm) transcription factor SMAD2 0.0125 0.2773 0.2773
Brugia malayi multidrug resistance related protein 1 0.0122 0.2698 0.2698
Echinococcus multilocularis multidrug resistance protein 1 0.0381 1 1
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0381 1 1
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0122 0.2698 0.2698
Echinococcus multilocularis ATP binding cassette sub family G 0.0356 0.9295 0.9259
Schistosoma mansoni tar DNA-binding protein 0.0066 0.1123 0.0885
Mycobacterium tuberculosis Iron-regulated transporter IrtA 0.0122 0.2698 0.2328
Brugia malayi Calcitonin receptor-like protein seb-1 0.0052 0.0726 0.0726
Schistosoma mansoni hypothetical protein 0.0295 0.7555 0.7489
Brugia malayi ABC transporter family protein 0.0381 1 1
Mycobacterium tuberculosis Probable conserved integral membrane protein ABC transporter 0.0054 0.0766 0.0298
Leishmania major p-glycoprotein 0.0381 1 1
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0381 1 1
Plasmodium falciparum ABC transporter B family member 6, putative 0.0122 0.2698 0.2698
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0482 0.0227
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0356 0.9295 1
Leishmania major ATP-binding cassette protein subfamily G, member 2, putative 0.0062 0.0998 0.0998
Mycobacterium ulcerans daunorubicin-DIM-transport integral membrane protein ABC transporter DrrC 0.0054 0.0766 0.0322
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0813 0.0567
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0381 1 1
Echinococcus multilocularis multidrug resistance associated protein 1 0.0122 0.2698 0.2328
Echinococcus granulosus multidrug resistance protein 1 0.0381 1 1
Echinococcus granulosus ATP binding cassette sub family B 0.0122 0.2698 0.2328
Trypanosoma brucei ABC transporter of the mitochondrion, putative 0.0122 0.2698 0.2903
Echinococcus granulosus 5'partial|ATP binding cassette sub family B 0.0373 0.9768 0.9756
Plasmodium vivax multidrug resistance protein 1, putative 0.0381 1 1
Leishmania major ABC-thiol transporter 0.0122 0.2698 0.2698
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0122 0.2698 0.2698
Schistosoma mansoni multidrug resistance protein 0.0381 1 1
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0381 1 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.0813 0.0348
Schistosoma mansoni tar DNA-binding protein 0.0066 0.1123 0.0885
Plasmodium vivax multidrug resistance protein 2, putative 0.0122 0.2698 0.2698
Trypanosoma brucei multidrug resistance-associated protein, putative 0.0122 0.2698 0.2903
Plasmodium falciparum ABC transporter B family member 5, putative 0.0122 0.2698 0.2698
Echinococcus granulosus ATP binding cassette sub family G 0.0356 0.9295 0.9259
Echinococcus multilocularis ATP binding cassette sub family B 0.0122 0.2698 0.2328
Plasmodium falciparum multidrug resistance protein 2 0.0122 0.2698 0.2698
Entamoeba histolytica P-glycoprotein 6, putative 0.0122 0.2698 0.2093
Entamoeba histolytica P-glycoprotein-2 0.0381 1 1
Loa Loa (eye worm) MH2 domain-containing protein 0.0125 0.2773 0.2773
Brugia malayi P-glycoprotein-like protein 0.0122 0.2698 0.2698
Trypanosoma brucei ABC transporter, putative 0.0062 0.0998 0.1073
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0055 0.0813 0.0813
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0381 1 1
Leishmania major ATP-binding cassette protein subfamily B, member 2, putative 0.0381 1 1
Loa Loa (eye worm) ABC transporter 0.0122 0.2698 0.2698
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0381 1 1
Plasmodium vivax ABC transporter G family member 2, putative 0.0356 0.9295 0.9295
Trypanosoma cruzi ABC transporter, putative 0.0356 0.9295 1
Entamoeba histolytica ABC transporter, putative 0.0356 0.9295 0.9236
Trypanosoma brucei ABC transporter, putative 0.0356 0.9295 1
Mycobacterium tuberculosis Probable O-antigen/lipopolysaccharide transport integral membrane protein ABC transporter RfbD 0.0054 0.0766 0.0298
Mycobacterium ulcerans component linked with the assembly of cytochrome transport transmembrane ATP-binding protein ABC transporter CydD 0.0122 0.2698 0.2515
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0052 0.0726 0.0726
Mycobacterium leprae PROBABLE DRUGS-TRANSPORT TRANSMEMBRANE ATP-BINDING PROTEIN ABC TRANSPORTER 0.0122 0.2698 1
Brugia malayi ABC transporter family protein 0.0122 0.2698 0.2698
Brugia malayi hypothetical protein 0.0054 0.0766 0.0766
Brugia malayi ABC transporter 0.0114 0.2467 0.2467
Toxoplasma gondii ATP-binding cassette G family transporter ABCG96 0.0062 0.0998 0.0998
Entamoeba histolytica P-glycoprotein-2 0.0381 1 1
Trichomonas vaginalis abcb9, putative 0.0381 1 1
Plasmodium vivax multidrug resistance-associated protein 1, putative 0.0122 0.2698 0.2698
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0122 0.2698 0.2698
Mycobacterium leprae PROBABLE DRUGS-TRANSPORT TRANSMEMBRANE ATP-BINDING PROTEIN ABC TRANSPORTER 0.0122 0.2698 1
Trypanosoma brucei ATP-binding cassette protein, putative 0.0356 0.9295 1
Trypanosoma cruzi ATP-binding cassette protein, putative 0.0356 0.9295 1
Entamoeba histolytica P-glyco protein 6, putative 0.0381 1 1
Loa Loa (eye worm) ATP-binding cassette sub-family B member 2 0.0381 1 1
Echinococcus granulosus multidrug resistance protein 1 0.0381 1 1
Brugia malayi RNA binding protein 0.0066 0.1123 0.1123
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0381 1 1
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.0482 0.0519
Trypanosoma cruzi hypothetical protein, conserved 0.0062 0.0998 0.1073
Trichomonas vaginalis ABC transporter, half transporter, putative 0.0381 1 1
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0043 0.0482 0.0482
Trypanosoma brucei p-glycoprotein 0.0122 0.2698 0.2903
Loa Loa (eye worm) hypothetical protein 0.0122 0.2698 0.2698
Echinococcus multilocularis multidrug resistance protein 1 0.0268 0.6791 0.6629
Schistosoma mansoni multidrug resistance protein 0.0122 0.2698 0.2503
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0381 1 1
Echinococcus granulosus multidrug resistance associated protein 1 0.0122 0.2698 0.2328
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0381 1 1
Leishmania major ATP-binding cassette protein subfamily G, member 4, putative 0.0356 0.9295 0.9295
Leishmania major ATP-binding cassette protein subfamily C, member 5, putative 0.0122 0.2698 0.2698
Loa Loa (eye worm) TAR-binding protein 0.0066 0.1123 0.1123
Plasmodium falciparum multidrug resistance protein 1 0.0381 1 1
Loa Loa (eye worm) hypothetical protein 0.0043 0.0482 0.0482
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0482 0.0227
Leishmania major ATP-binding cassette protein subfamily G, member 1, putative 0.0062 0.0998 0.0998
Trypanosoma cruzi ATP-binding cassette protein subfamily G 0.0062 0.0998 0.1073
Brugia malayi ABC transporter family protein 0.0303 0.7787 0.7787
Entamoeba histolytica P-glycoprotein 6, putative 0.0122 0.2698 0.2093
Loa Loa (eye worm) ABC transporter 0.0122 0.2698 0.2698
Trypanosoma cruzi ATP-binding cassette protein subfamily G 0.0062 0.0998 0.1073
Brugia malayi beta-lactamase family protein 0.0043 0.0482 0.0482
Schistosoma mansoni ABC transporter 0.0054 0.0766 0.0518
Toxoplasma gondii ABC1 family protein 0.0043 0.0482 0.0482
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0356 0.9295 1
Wolbachia endosymbiont of Brugia malayi ABC-type multidrug transport system, ATPase and permease component 0.0122 0.2698 0.5
Plasmodium vivax ABC transporter B family member 4, putative 0.0122 0.2698 0.2698
Entamoeba histolytica ATP-binding cassette protein, putative 0.0122 0.2698 0.2093
Mycobacterium tuberculosis Probable conserved transmembrane ATP-binding protein ABC transporter 0.0295 0.7555 0.7431
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0356 0.9295 1
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0122 0.2698 0.2328
Schistosoma mansoni ATP-binding cassette sub-family g2 (white protein) (abcg2) 0.0356 0.9295 0.9276
Entamoeba histolytica ABC transporter, putative 0.0122 0.2698 0.2093
Trypanosoma cruzi hypothetical protein, conserved 0.0054 0.0766 0.0824
Mycobacterium ulcerans antibiotic ABC transporter transmembrane protein 0.0054 0.0766 0.0322
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0381 1 1
Plasmodium vivax hypothetical protein, conserved 0.0043 0.0482 0.0482
Schistosoma mansoni multidrug resistance protein 0.0381 1 1
Schistosoma mansoni multidrug resistance protein 0.0114 0.2467 0.2265
Brugia malayi RNA recognition motif domain containing protein 0.0066 0.1123 0.1123
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0381 1 1
Echinococcus multilocularis ATP binding cassette sub family G 0.0356 0.9295 0.9259
Schistosoma mansoni multidrug resistance protein 0.0381 1 1
Trypanosoma brucei ATP-binding cassette protein subfamily G 0.0062 0.0998 0.1073
Mycobacterium tuberculosis Probable daunorubicin-dim-transport integral membrane protein ABC transporter DrrC 0.0054 0.0766 0.0298
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0381 1 1
Entamoeba histolytica multidrug resistance protein, putative 0.0122 0.2698 0.2093
Leishmania major ATP-binding cassette protein subfamily C, member 8, putative 0.0122 0.2698 0.2698
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0381 1 1
Brugia malayi hypothetical protein 0.0122 0.2698 0.2698
Loa Loa (eye worm) hypothetical protein 0.0043 0.0482 0.0482
Giardia lamblia ABC transporter, putative 0.0122 0.2698 0.0351
Leishmania major ATP-binding cassette protein subfamily C, member 1, putative 0.0122 0.2698 0.2698
Echinococcus multilocularis 0.0122 0.2698 0.2328
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0381 1 1
Leishmania major ATP-binding cassette protein subfamily B, member 3, putative 0.0122 0.2698 0.2698
Toxoplasma gondii ATP-binding cassette G family transporter ABCG87 0.0062 0.0998 0.0998
Echinococcus multilocularis multidrug resistance protein 1 0.0381 1 1
Brugia malayi ABC transporter transmembrane region family protein 0.0114 0.2467 0.2467
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0052 0.0726 0.0726
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0381 1 1
Schistosoma mansoni multidrug resistance protein 0.0122 0.2698 0.2503
Loa Loa (eye worm) multidrug resistance protein 3 0.0381 1 1
Entamoeba histolytica ATP-binding cassette protein, putative 0.0122 0.2698 0.2093
Entamoeba histolytica ATP-binding cassette protein, putative 0.0122 0.2698 0.2093
Entamoeba histolytica P-glycoprotein 5, putative 0.0381 1 1
Mycobacterium ulcerans antibiotic resistance ABC transporter efflux protein 0.0054 0.0766 0.0322
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0813 0.0567
Giardia lamblia Multidrug resistance-associated protein 1 0.0122 0.2698 0.0351
Brugia malayi ABC transporter 0.0122 0.2698 0.2698
Loa Loa (eye worm) hypothetical protein 0.0114 0.2467 0.2467
Mycobacterium tuberculosis Probable drugs-transport transmembrane ATP-binding protein ABC transporter 0.0122 0.2698 0.2328
Echinococcus granulosus multidrug resistance protein 1 0.0268 0.6791 0.6629
Plasmodium falciparum ABC transporter B family member 7, putative 0.0122 0.2698 0.2698
Toxoplasma gondii ATP-binding cassette transporter ABC.B1 0.0381 1 1
Schistosoma mansoni tar DNA-binding protein 0.0066 0.1123 0.0885
Mycobacterium ulcerans O-antigen/lipopolysaccharide transport integral membrane protein ABC transporter RfbD 0.0054 0.0766 0.0322
Plasmodium falciparum multidrug resistance-associated protein 1 0.0122 0.2698 0.2698
Echinococcus multilocularis ATP binding cassette sub family G 0.0356 0.9295 0.9259
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0122 0.2698 0.2698
Trypanosoma cruzi multidrug resistance-associated protein, putative 0.0122 0.2698 0.2903
Trypanosoma cruzi ABC transporter, putative 0.0054 0.0766 0.0824
Leishmania major pentamidine resistance protein 1 0.0122 0.2698 0.2698
Entamoeba histolytica P-glycoprotein-2, putative 0.0114 0.2467 0.1842
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.0482 0.0519
Toxoplasma gondii ATP-binding cassette G family transporter ABCG89 0.0062 0.0998 0.0998
Brugia malayi beta-lactamase family protein 0.0043 0.0482 0.0482
Trypanosoma cruzi ABC transporter, putative 0.0062 0.0998 0.1073
Schistosoma mansoni ATP-binding cassette sub-family B member 7 mitochondrial precursor (abc7) 0.0122 0.2698 0.2503
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0381 1 1
Loa Loa (eye worm) hypothetical protein 0.0054 0.0766 0.0766
Brugia malayi RE11181p 0.0054 0.0766 0.0766
Echinococcus multilocularis multidrug resistance associated protein 7 0.0122 0.2698 0.2328
Brugia malayi latrophilin 2 splice variant baaae 0.0036 0.0261 0.0261
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0122 0.2698 0.2698
Echinococcus granulosus ATP binding cassette sub family B 0.0122 0.2698 0.2328
Giardia lamblia MRP-like ABC transporter 0.0122 0.2698 0.0351
Toxoplasma gondii ATP-binding cassette sub-family B member 5 0.0122 0.2698 0.2698
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0122 0.2698 0.2515
Echinococcus granulosus ATP binding cassette sub family G 0.0356 0.9295 0.9259
Mycobacterium ulcerans antibiotic ABC transporter integral membrane protein 0.0054 0.0766 0.0322
Loa Loa (eye worm) hypothetical protein 0.0043 0.0482 0.0482
Mycobacterium ulcerans hypothetical protein 0.0054 0.0766 0.0322
Echinococcus granulosus ATP binding cassette sub family G 0.0356 0.9295 0.9259
Entamoeba histolytica P-glycoprotein-5 0.0381 1 1
Loa Loa (eye worm) hypothetical protein 0.0373 0.9768 0.9768
Trypanosoma cruzi hypothetical protein, conserved 0.0062 0.0998 0.1073
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0381 1 1
Trypanosoma brucei multidrug resistance-associated protein, putative 0.0122 0.2698 0.2903
Trypanosoma brucei hypothetical protein, conserved 0.0043 0.0482 0.0519
Loa Loa (eye worm) hypothetical protein 0.0052 0.0726 0.0726
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0381 1 1
Loa Loa (eye worm) hypothetical protein 0.0114 0.2467 0.2467
Toxoplasma gondii ATP-binding cassette G family transporter ABCG107 0.0062 0.0998 0.0998
Brugia malayi ABC transporter transmembrane region family protein 0.0122 0.2698 0.2698
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0278 0.708 0.6932
Loa Loa (eye worm) hypothetical protein 0.0381 1 1
Leishmania major p-glycoprotein e 0.0122 0.2698 0.2698
Schistosoma mansoni ATP-binding cassette sub-family B member 6 mitochondrial precursor (abc6) 0.0114 0.2467 0.2265
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.0813 0.0348
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0381 1 1
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0381 1 1
Trypanosoma cruzi ABC transporter of the mitochondrion, putative 0.0122 0.2698 0.2903
Echinococcus granulosus multidrug resistance protein 1 0.0381 1 1
Schistosoma mansoni tar DNA-binding protein 0.0066 0.1123 0.0885
Brugia malayi MH2 domain containing protein 0.0125 0.2773 0.2773
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0114 0.2467 0.2085
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0381 1 1
Entamoeba histolytica hypothetical protein 0.0122 0.2698 0.2093
Toxoplasma gondii ABC transporter, putative 0.0122 0.2698 0.2698
Trichomonas vaginalis abcb9, putative 0.0381 1 1
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0381 1 1
Brugia malayi ABC transporter transmembrane region family protein 0.0122 0.2698 0.2698
Loa Loa (eye worm) hypothetical protein 0.0043 0.0482 0.0482
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0122 0.2698 0.2698
Schistosoma mansoni multidrug resistance protein 0.0122 0.2698 0.2503
Toxoplasma gondii ABC transporter family protein 0.0122 0.2698 0.2698
Echinococcus granulosus multidrug resistance protein 1 0.0268 0.6791 0.6629
Loa Loa (eye worm) beta-lactamase 0.0043 0.0482 0.0482
Loa Loa (eye worm) hypothetical protein 0.0043 0.0482 0.0482
Loa Loa (eye worm) ABC transporter transmembrane region family protein 0.0122 0.2698 0.2698
Brugia malayi ABC transporter family protein 0.0122 0.2698 0.2698
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0114 0.2467 0.2085
Trypanosoma cruzi multidrug resistance protein E, putative 0.0122 0.2698 0.2903
Leishmania major ATP-binding cassette protein subfamily C, member 6, putative 0.0122 0.2698 0.2698
Brugia malayi ABC transporter family protein 0.0122 0.2698 0.2698
Trichomonas vaginalis taga, putative 0.0381 1 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0055 0.0813 0.0813
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0268 0.6791 0.6629
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.0813 0.0348
Trichomonas vaginalis ABC transporter, putative 0.0381 1 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.0813 0.0348

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.7943 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) = 5.0119 um PUBCHEM_BIOASSAY: qHTS Inhibitors of AmpC Beta-Lactamase (assay with detergent). (Class of assay: confirmatory) [Related pubchem assays: 1002 (Confirmation Concentration-Response Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent)), 585 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay without detergent) - a screen old NIH MLSMR collection), 584 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay with detergent) - a screen of the old NIH MLSMR collection), 1003 (Confirmation Cuvette-Based Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent))] ChEMBL. No reference
Potency (functional) 31.6228 uM PUBCHEM_BIOASSAY: qHTS assay of beta-arrestin-biased ligands of beta2-adrenergic receptor. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID485366, AID485386, AID504448, AID504454, AID504459] ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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