Detailed information for compound 1316123

Basic information

Technical information
  • TDR Targets ID: 1316123
  • Name: 3-thiophen-2-yl-6-(trifluoromethyl)thieno[4,5 -b]pyridine-2-carbohydrazide
  • MW: 343.347 | Formula: C13H8F3N3OS2
  • H donors: 2 H acceptors: 2 LogP: 3.05 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: NNC(=O)c1sc2c(c1c1cccs1)ncc(c2)C(F)(F)F
  • InChi: 1S/C13H8F3N3OS2/c14-13(15,16)6-4-8-10(18-5-6)9(7-2-1-3-21-7)11(22-8)12(20)19-17/h1-5H,17H2,(H,19,20)
  • InChiKey: DEOCQVAUZKNFQQ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 3-(2-thienyl)-6-(trifluoromethyl)thieno[4,5-b]pyridine-2-carbohydrazide
  • 3-(2-thienyl)-6-(trifluoromethyl)-2-thieno[4,5-b]pyridinecarbohydrazide
  • 3-(2-thienyl)-6-(trifluoromethyl)thieno[3,2-b]pyridine-2-carbohydrazide
  • MLS000694972
  • SMR000334855
  • ZINC01405126
  • 11J-008

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Mus musculus RAR-related orphan receptor gamma Starlite/ChEMBL No references
Homo sapiens aldehyde dehydrogenase 1 family, member A1 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus granulosus aldehyde dehydrogenase mitochondrial Get druggable targets OG5_126638 All targets in OG5_126638
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum Retinal dehydrogenase 1, putative Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial Get druggable targets OG5_126638 All targets in OG5_126638
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania infantum aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma mansoni aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Toxoplasma gondii aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Candida albicans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum Aldehyde dehydrogenase, mitochondrial precursor, putative Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania major aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania donovani aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Candida albicans Mitochondrial aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania mexicana aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum Aldehyde dehydrogenase X, mitochondrial precursor, putative Get druggable targets OG5_126638 All targets in OG5_126638
Candida albicans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma mansoni aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Mycobacterium tuberculosis Probable aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Candida albicans Mitochondrial aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Neospora caninum hypothetical protein Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum ko:K00128 aldehyde dehydrogenase (NAD+) [EC1.2.1.3], putative Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania braziliensis aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Mycobacterium tuberculosis Succinate-semialdehyde dehydrogenase [NADP+] dependent (SSDH) GabD1 aldehyde dehydrogenase 1 family, member A1 501 aa 456 aa 33.3 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0314 1 1
Echinococcus granulosus multidrug resistance protein 1 0.0314 1 1
Entamoeba histolytica P-glycoprotein 6, putative 0.0101 0.2856 0.0162
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0314 1 1
Loa Loa (eye worm) hypothetical protein 0.0097 0.2739 0.2739
Brugia malayi Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog 0.0029 0.0439 0.0252
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0113 0.3256 0.1638
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0086 0.2349 0.2199
Leishmania major p-glycoprotein 0.0314 1 1
Trichomonas vaginalis abcb9, putative 0.0314 1 1
Trypanosoma brucei multidrug resistance-associated protein, putative 0.0113 0.3256 1
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0314 1 1
Toxoplasma gondii ABC transporter, putative 0.0101 0.2856 0.1142
Loa Loa (eye worm) inward rectifying k channel family protein 1 0.0184 0.5643 0.5643
Echinococcus multilocularis sodium channel protein 0.0087 0.2395 0.2246
Trypanosoma brucei multidrug resistance protein E 0.0113 0.3256 1
Echinococcus granulosus ATP binding cassette sub family B 0.0101 0.2856 0.2717
Brugia malayi P-glycoprotein-like protein 0.0101 0.2856 0.2717
Loa Loa (eye worm) ABC transporter 0.0101 0.2856 0.2856
Echinococcus multilocularis 0.0101 0.2856 0.2717
Entamoeba histolytica ATP-binding cassette protein, putative 0.0113 0.3256 0.0712
Echinococcus granulosus multidrug resistance protein 1 0.0314 1 1
Schistosoma mansoni aldehyde dehydrogenase 0.0073 0.1935 0.1867
Loa Loa (eye worm) hypothetical protein 0.0184 0.5643 0.5643
Entamoeba histolytica P-glycoprotein-2, putative 0.0314 1 1
Leishmania major ATP-binding cassette protein subfamily B, member 2, putative 0.0314 1 1
Entamoeba histolytica hypothetical protein 0.0113 0.3256 0.0712
Entamoeba histolytica P-glycoprotein 5, putative 0.0314 1 1
Trypanosoma brucei p-glycoprotein 0.0113 0.3256 1
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0314 1 1
Echinococcus multilocularis ATP binding cassette sub family B 0.0311 0.9882 0.988
Loa Loa (eye worm) hypothetical protein 0.0311 0.9882 0.9882
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0314 1 1
Leishmania major ATP-binding cassette protein subfamily C, member 1, putative 0.0113 0.3256 0.1638
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0073 0.1935 0.1777
Loa Loa (eye worm) hypothetical protein 0.0184 0.5643 0.5643
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0314 1 1
Schistosoma mansoni voltage-gated potassium channel 0.0093 0.2596 0.2533
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0314 1 1
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0029 0.0439 0.0252
Toxoplasma gondii ABC transporter family protein 0.0101 0.2856 0.1142
Schistosoma mansoni multidrug resistance protein 0.0314 1 1
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0314 1 1
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0314 1 1
Echinococcus multilocularis ATP binding cassette sub family B 0.0101 0.2856 0.2717
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0101 0.2856 0.1142
Leishmania major ATP-binding cassette protein subfamily C, member 6, putative 0.0113 0.3256 0.1638
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0073 0.1935 0.1777
Schistosoma mansoni voltage-gated potassium channel 0.0029 0.0439 0.0358
Trypanosoma cruzi multidrug resistance-associated protein, putative 0.0113 0.3256 1
Loa Loa (eye worm) ABC transporter 0.0101 0.2856 0.2856
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0075 0.1995 0.1838
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0314 1 1
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0101 0.2856 1
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0314 1 1
Loa Loa (eye worm) hypothetical protein 0.0113 0.3256 0.3256
Schistosoma mansoni multidrug resistance protein 0.0113 0.3256 0.3199
Brugia malayi hypothetical protein 0.0101 0.2856 0.2717
Chlamydia trachomatis ABC transporter ATP binding protein/permease 0.0314 1 0.5
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0314 1 1
Schistosoma mansoni multidrug resistance protein 0.0314 1 1
Leishmania major ATP-binding cassette protein subfamily C, member 8, putative 0.0101 0.2856 0.1142
Echinococcus multilocularis multidrug resistance protein 1 0.0314 1 1
Leishmania major ATP-binding cassette protein subfamily C, member 5, putative 0.0113 0.3256 0.1638
Schistosoma mansoni smdr2 0.0314 1 1
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0101 0.2856 0.1142
Loa Loa (eye worm) hypothetical protein 0.0113 0.3256 0.3256
Giardia lamblia Multidrug resistance-associated protein 1 0.0113 0.3256 1
Plasmodium vivax multidrug resistance protein 1, putative 0.0314 1 1
Trichomonas vaginalis ABC transporter, half transporter, putative 0.0314 1 1
Echinococcus granulosus multidrug resistance protein 1 0.0217 0.6744 0.668
Mycobacterium tuberculosis Iron-regulated transporter IrtA 0.0101 0.2856 0.1142
Schistosoma mansoni voltage-gated potassium channel 0.0093 0.2596 0.2533
Schistosoma mansoni multidrug resistance protein 0.0314 1 1
Mycobacterium tuberculosis Probable transmembrane multidrug efflux pump 0.0314 1 1
Echinococcus multilocularis multidrug resistance protein 1 0.0217 0.6744 0.668
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0075 0.1995 0.1838
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0101 0.2856 0.1142
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0101 0.2856 1
Schistosoma mansoni ATP-binding cassette sub-family B member 7 mitochondrial precursor (abc7) 0.0101 0.2856 0.2796
Loa Loa (eye worm) hypothetical protein 0.0101 0.2856 0.2856
Brugia malayi ABC transporter transmembrane region family protein 0.0113 0.3256 0.3124
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0097 0.2739 0.2597
Schistosoma mansoni multidrug resistance protein 0.0113 0.3256 0.3199
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0314 1 1
Leishmania major ATP-binding cassette protein subfamily B, member 3, putative 0.0101 0.2856 0.1142
Loa Loa (eye worm) hypothetical protein 0.0021 0.0192 0.0192
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0314 1 1
Echinococcus multilocularis ATP binding cassette sub family B 0.0101 0.2856 0.2717
Mycobacterium leprae PROBABLE DRUGS-TRANSPORT TRANSMEMBRANE ATP-BINDING PROTEIN ABC TRANSPORTER 0.0101 0.2856 0.5
Schistosoma mansoni ATP-binding cassette sub-family B member 6 mitochondrial precursor (abc6) 0.0097 0.2739 0.2677
Schistosoma mansoni voltage-gated potassium channel 0.0021 0.0192 0.0109
Echinococcus multilocularis multidrug resistance associated protein 1 0.0113 0.3256 0.3124
Schistosoma mansoni smdr1 0.0101 0.2856 0.2796
Trichomonas vaginalis ABC transporter, putative 0.0314 1 1
Loa Loa (eye worm) hypothetical protein 0.0314 1 1
Schistosoma mansoni voltage-gated potassium channel 0.0029 0.0439 0.0358
Entamoeba histolytica P-glycoprotein-2 0.0314 1 1
Loa Loa (eye worm) hypothetical protein 0.0184 0.5643 0.5643
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0314 1 1
Toxoplasma gondii ATP-binding cassette sub-family B member 5 0.0101 0.2856 0.1142
Schistosoma mansoni multidrug resistance protein 0.0113 0.3256 0.3199
Loa Loa (eye worm) ATP-binding cassette sub-family B member 2 0.0314 1 1
Entamoeba histolytica P-glyco protein 6, putative 0.0314 1 1
Entamoeba histolytica P-glycoprotein-2 0.0314 1 1
Plasmodium falciparum multidrug resistance protein 1 0.0314 1 1
Loa Loa (eye worm) hypothetical protein 0.0029 0.0439 0.0439
Echinococcus multilocularis ATP binding cassette sub family B 0.0101 0.2856 0.2717
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.0086 0.2349 0.2349
Leishmania major ATP-binding cassette protein subfamily C, member 2, putative 0.0113 0.3256 0.1638
Schistosoma mansoni multidrug resistance protein 0.0113 0.3256 0.3199
Loa Loa (eye worm) hypothetical protein 0.0109 0.3138 0.3138
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0101 0.2856 0.1142
Entamoeba histolytica ATP-binding cassette protein, putative 0.0113 0.3256 0.0712
Trichomonas vaginalis abcb9, putative 0.0314 1 1
Entamoeba histolytica ATP-binding cassette protein, putative 0.0113 0.3256 0.0712
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.0021 0.0192 0.0109
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0314 1 1
Echinococcus granulosus sodium channel protein 0.0087 0.2395 0.2246
Entamoeba histolytica multidrug resistance protein, putative 0.0113 0.3256 0.0712
Echinococcus granulosus multidrug resistance associated protein 7 0.0113 0.3256 0.3124
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0314 1 1
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0029 0.0439 0.0252
Brugia malayi ABC transporter 0.0097 0.2739 0.2597
Mycobacterium ulcerans drugs-transport transmembrane ATP-binding protein ABC transporter 0.0101 0.2856 1
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0021 0.0192 0.0109
Echinococcus multilocularis ATP binding cassette sub family B 0.0101 0.2856 0.2717
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.0086 0.2349 0.2199
Trypanosoma cruzi multidrug resistance protein E, putative 0.0113 0.3256 1
Trypanosoma cruzi multidrug resistance-associated protein, putative 0.0113 0.3256 1
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0101 0.2856 1
Brugia malayi multidrug resistance related protein 1 0.0113 0.3256 0.3124
Entamoeba histolytica ABC transporter, putative 0.0113 0.3256 0.0712
Trypanosoma brucei multidrug resistance-associated protein, putative 0.0113 0.3256 1
Leishmania major p-glycoprotein e 0.0113 0.3256 0.1638
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.0021 0.0192 0.0109
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0314 1 1
Echinococcus multilocularis voltage gated potassium channel 0.0029 0.0439 0.0252
Loa Loa (eye worm) cyclic-nucleotide gated cation channel 0.0021 0.0192 0.0192
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0097 0.2739 0.2597
Giardia lamblia Multidrug resistance-associated protein 1 0.0113 0.3256 1
Wolbachia endosymbiont of Brugia malayi ABC-type multidrug transport system, ATPase and permease component 0.0101 0.2856 0.5
Mycobacterium ulcerans component linked with the assembly of cytochrome transport transmembrane ATP-binding protein ABC transporter CydD 0.0101 0.2856 1
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0314 1 1
Entamoeba histolytica ATP-binding cassette protein, putative 0.0113 0.3256 0.0712
Giardia lamblia MRP-like ABC transporter 0.0113 0.3256 1
Giardia lamblia ABC transporter, putative 0.0113 0.3256 1
Echinococcus granulosus 5'partial|ATP binding cassette sub family B 0.0311 0.9882 0.988
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0314 1 1
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0021 0.0192 0.0109
Brugia malayi ABC transporter 0.0101 0.2856 0.2717
Leishmania major ATP-binding cassette protein subfamily B, member 1, putative 0.0101 0.2856 0.1142
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0314 1 1
Loa Loa (eye worm) ABC transporter 0.0101 0.2856 0.2856
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0314 1 1
Trichomonas vaginalis ABC transporter, putative 0.0314 1 1
Loa Loa (eye worm) cyclic-nucleotide gated cation channel 0.0021 0.0192 0.0192
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0314 1 1
Toxoplasma gondii hypothetical protein 0.0184 0.5643 0.4598
Onchocerca volvulus 0.0314 1 0.5
Toxoplasma gondii ATP-binding cassette transporter ABC.B1 0.0314 1 1
Trichomonas vaginalis taga, putative 0.0314 1 1
Schistosoma mansoni multidrug resistance protein 0.0097 0.2739 0.2677
Wolbachia endosymbiont of Brugia malayi ABC-type protease secretion system, ATPase and permease component, AprD 0.0101 0.2856 0.5
Echinococcus granulosus ATP binding cassette sub family B 0.0101 0.2856 0.2717
Loa Loa (eye worm) hypothetical protein 0.0314 1 1
Brugia malayi ABC transporter transmembrane region family protein 0.0101 0.2856 0.2717
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0021 0.0192 0.0109
Echinococcus granulosus voltage gated potassium channel 0.0029 0.0439 0.0252
Entamoeba histolytica P-glycoprotein-5 0.0314 1 1
Echinococcus multilocularis multidrug resistance associated protein 7 0.0113 0.3256 0.3124
Echinococcus granulosus multidrug resistance associated protein 1 0.0113 0.3256 0.3124
Loa Loa (eye worm) multidrug resistance protein 3 0.0314 1 1
Trichomonas vaginalis conserved hypothetical protein 0.0097 0.2739 0.2597
Brugia malayi ABC transporter family protein 0.0314 1 1
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0101 0.2856 0.1142
Trichomonas vaginalis ABC transporter, putative 0.0314 1 1
Mycobacterium leprae PROBABLE DRUGS-TRANSPORT TRANSMEMBRANE ATP-BINDING PROTEIN ABC TRANSPORTER 0.0101 0.2856 0.5
Echinococcus granulosus ATP binding cassette sub family B 0.0097 0.2739 0.2597
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0314 1 1
Loa Loa (eye worm) hypothetical protein 0.0075 0.1994 0.1994
Echinococcus granulosus multidrug resistance protein 1 0.0314 1 1
Schistosoma mansoni multidrug resistance protein 0.0101 0.2856 0.2796
Giardia lamblia Multidrug resistance-associated protein 1 0.0109 0.3138 0.7726
Trichomonas vaginalis ABC transporter, half transporter, putative 0.0314 1 1
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0314 1 1
Brugia malayi ABC transporter family protein 0.0101 0.2856 0.2717
Schistosoma mansoni aldehyde dehydrogenase 0.0073 0.1935 0.1867
Entamoeba histolytica P-glycoprotein-1 0.0314 1 1
Brugia malayi ABC transporter family protein 0.0101 0.2856 0.2717
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0314 1 1
Brugia malayi multidrug Resistance Protein family member (mrp-5), putative 0.0101 0.2856 0.2717
Trichomonas vaginalis abcb9, putative 0.0314 1 1
Echinococcus multilocularis multidrug resistance protein 1 0.0314 1 1
Echinococcus granulosus multidrug resistance protein 1 0.0217 0.6744 0.668
Mycobacterium tuberculosis Probable drugs-transport transmembrane ATP-binding protein ABC transporter 0.0101 0.2856 0.1142
Loa Loa (eye worm) ABC transporter transmembrane region family protein 0.0113 0.3256 0.3256
Leishmania major calcium channel protein, putative,ion transporter, putative 0.0087 0.2395 0.057
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0314 1 1
Echinococcus granulosus voltage gated sodium channel Nav1 alpha subunit 0.0087 0.2395 0.2246
Leishmania major pentamidine resistance protein 1 0.0113 0.3256 0.1638
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0314 1 1
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0086 0.2349 0.2199
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0097 0.2739 0.2597
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0101 0.2856 0.2717
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0314 1 1
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0217 0.6744 0.668
Trichomonas vaginalis ABC transporter, putative 0.0314 1 1
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0314 1 1
Leishmania major ABC-thiol transporter 0.0113 0.3256 0.1638
Brugia malayi ABC transporter transmembrane region family protein 0.0097 0.2739 0.2597
Entamoeba histolytica P-glycoprotein 6, putative 0.0101 0.2856 0.0162
Brugia malayi ABC transporter family protein 0.0101 0.2856 0.2717

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 0.1995 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Aldehyde Dehydrogenase 1 (ALDH1A1). (Class of assay: confirmatory) [Related pubchem assays: 1030 (qHTS Validation Assay for Inhibitors of aldehyde dehydrogenase 1 (ALDH1A1))] ChEMBL. No reference
Potency (functional) = 10 um PUBCHEM_BIOASSAY: VP16 counterscreen qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 10 um PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 18.526 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) = 28.1838 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human Jumonji Domain Containing 2E (JMJD2E). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 29.0929 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in SW480 colon adenocarcinoma cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 32.9444 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 35.4813 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) = 44.6684 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors and Activators of Human alpha-Glucosidase Cleavage of Glycogen. (Class of assay: confirmatory) [Related pubchem assays: 1473, 1466 ] ChEMBL. No reference
Potency (functional) 100 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) 100 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23

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.