Detailed information for compound 1256117

Basic information

Technical information
  • TDR Targets ID: 1256117
  • Name: N'-[2-(4-amino-5-cyanopyrimidin-2-yl)sulfanyl acetyl]-2-(4-methylphenoxy)acetohydrazide
  • MW: 372.402 | Formula: C16H16N6O3S
  • H donors: 3 H acceptors: 5 LogP: 1.89 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 1
  • SMILES: N#Cc1cnc(nc1N)SCC(=O)NNC(=O)COc1ccc(cc1)C
  • InChi: 1S/C16H16N6O3S/c1-10-2-4-12(5-3-10)25-8-13(23)21-22-14(24)9-26-16-19-7-11(6-17)15(18)20-16/h2-5,7H,8-9H2,1H3,(H,21,23)(H,22,24)(H2,18,19,20)
  • InChiKey: FEPWHJZCQSXKQD-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N'-[2-(4-amino-5-cyano-pyrimidin-2-yl)sulfanylacetyl]-2-(4-methylphenoxy)acetohydrazide
  • N'-[2-[(4-amino-5-cyano-2-pyrimidinyl)thio]-1-oxoethyl]-2-(4-methylphenoxy)acetohydrazide
  • N'-[2-[(4-amino-5-cyano-pyrimidin-2-yl)thio]acetyl]-2-(4-methylphenoxy)acetohydrazide
  • N'-[2-(4-amino-5-cyano-pyrimidin-2-yl)sulfanylethanoyl]-2-(4-methylphenoxy)ethanehydrazide
  • ASN 03016793
  • ZINC04126878
  • MLS000569079
  • SMR000172547
  • p-Tolyloxy-acetic acid N'-[2-(4-amino-5-cyano-pyrimidin-2-ylsulfanyl)-acetyl]-hydrazide

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens karyopherin (importin) beta 1 No references
Mus musculus RAR-related orphan receptor gamma Starlite/ChEMBL No references
Homo sapiens snurportin 1 No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Plasmodium falciparum importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Candida albicans karyopherin-beta Get druggable targets OG5_127843 All targets in OG5_127843
Neospora caninum hypothetical protein Get druggable targets OG5_127843 All targets in OG5_127843
Trichomonas vaginalis importin beta-1, putative Get druggable targets OG5_127843 All targets in OG5_127843
Entamoeba histolytica hypothetical protein Get druggable targets OG5_127843 All targets in OG5_127843
Brugia malayi Importin beta-1 subunit Get druggable targets OG5_127843 All targets in OG5_127843
Trypanosoma cruzi importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Theileria parva importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma japonicum Importin subunit beta-1, putative Get druggable targets OG5_127843 All targets in OG5_127843
Trichomonas vaginalis Importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Brugia malayi RNA, U transporter 1 Get druggable targets OG5_131808 All targets in OG5_131808
Schistosoma mansoni hypothetical protein Get druggable targets OG5_131808 All targets in OG5_131808
Echinococcus multilocularis snurportin 1 Get druggable targets OG5_131808 All targets in OG5_131808
Echinococcus multilocularis importin subunit beta 1 Get druggable targets OG5_127843 All targets in OG5_127843
Cryptosporidium parvum importin/karyopherin Get druggable targets OG5_127843 All targets in OG5_127843
Cryptosporidium hominis importin-beta2 Get druggable targets OG5_127843 All targets in OG5_127843
Trypanosoma brucei importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Trypanosoma congolense importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Candida albicans karyopherin-beta Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania infantum importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania donovani importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Trichomonas vaginalis Importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma japonicum Snurportin-1, putative Get druggable targets OG5_131808 All targets in OG5_131808
Schistosoma japonicum Importin subunit beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus granulosus snurportin 1 Get druggable targets OG5_131808 All targets in OG5_131808
Plasmodium berghei importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania major importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma mansoni importin beta-1 Get druggable targets OG5_127843 All targets in OG5_127843
Trypanosoma brucei gambiense importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania braziliensis importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania mexicana importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Loa Loa (eye worm) nucleolar RNA-associated protein alpha Get druggable targets OG5_131808 All targets in OG5_131808
Plasmodium vivax importin-beta 2, putative Get druggable targets OG5_127843 All targets in OG5_127843
Babesia bovis importin beta subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus granulosus importin subunit beta 1 Get druggable targets OG5_127843 All targets in OG5_127843
Trypanosoma brucei importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Toxoplasma gondii HEAT repeat-containing protein Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium yoelii importin beta-1 subunit Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium knowlesi importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trypanosoma cruzi cruzipain precursor, putative 0.0145 0.3301 0.41
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0079 0.1338 0.4054
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0145 0.3301 1
Loa Loa (eye worm) hypothetical protein 0.01 0.1963 0.1963
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0145 0.3301 1
Plasmodium falciparum cysteine proteinase falcipain 3 0.0145 0.3301 1
Loa Loa (eye worm) ctsf protein 0.0145 0.3301 0.3301
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0306 0.8052 0.8052
Trypanosoma cruzi cysteine peptidase, putative 0.0145 0.3301 0.41
Echinococcus multilocularis snurportin 1 0.0372 1 1
Loa Loa (eye worm) hypothetical protein 0.0306 0.8052 0.8052
Echinococcus multilocularis cysteine protease 0.0145 0.3301 0.3301
Giardia lamblia Cathepsin B precursor 0.0118 0.249 1
Trypanosoma cruzi cysteine proteinase, putative 0.0079 0.1338 0.1662
Brugia malayi Cathepsin L-like precursor 0.0045 0.0342 0.0425
Loa Loa (eye worm) hypothetical protein 0.0145 0.3301 0.3301
Loa Loa (eye worm) hypothetical protein 0.0045 0.0342 0.0342
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0145 0.3301 1
Entamoeba histolytica cysteine proteinase, putative 0.0145 0.3301 1
Onchocerca volvulus 0.0145 0.3301 1
Entamoeba histolytica cysteine proteinase, putative 0.01 0.1963 0.5946
Schistosoma mansoni cathepsin F (C01 family) 0.01 0.1963 0.1963
Onchocerca volvulus Cathepsin L homolog 0.0145 0.3301 1
Leishmania major cysteine peptidase A (CPA) 0.0145 0.3301 1
Brugia malayi Cathepsin L-like precursor 0.0145 0.3301 0.41
Plasmodium vivax importin-beta 2, putative 0.0035 0.0034 0.0103
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0079 0.1338 0.3992
Echinococcus multilocularis cathepsin L cysteine protease 0.0145 0.3301 0.3301
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0145 0.3301 1
Entamoeba histolytica cysteine protease, putative 0.0079 0.1338 0.4054
Trypanosoma cruzi cysteine peptidase, putative 0.0145 0.3301 0.41
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0145 0.3301 1
Brugia malayi Cathepsin L-like precursor 0.01 0.1963 0.2438
Brugia malayi RNA, U transporter 1 0.0099 0.1933 0.2401
Entamoeba histolytica cysteine proteinase, putative 0.0079 0.1338 0.4054
Entamoeba histolytica cysteine proteinase 2 0.0079 0.1338 0.4054
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0145 0.3301 1
Entamoeba histolytica cysteine protease, putative 0.0079 0.1338 0.4054
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0145 0.3301 1
Plasmodium vivax vivapain-3 0.0079 0.1338 0.4054
Loa Loa (eye worm) hypothetical protein 0.01 0.1963 0.1963
Loa Loa (eye worm) hypothetical protein 0.0045 0.0342 0.0342
Entamoeba histolytica cysteine protease, putative 0.0079 0.1338 0.4054
Schistosoma mansoni cathepsin F (C01 family) 0.0145 0.3301 0.3301
Onchocerca volvulus 0.0145 0.3301 1
Leishmania major cathepsin L-like protease 0.0145 0.3301 1
Giardia lamblia Cathepsin B precursor 0.0118 0.249 1
Echinococcus granulosus cathepsin L 0.0079 0.1338 0.1338
Loa Loa (eye worm) cathepsin B 0.0118 0.249 0.249
Trypanosoma cruzi cysteine protease, putative 0.0079 0.1338 0.1662
Onchocerca volvulus 0.0145 0.3301 1
Brugia malayi Papain family cysteine protease containing protein 0.0079 0.1338 0.1662
Brugia malayi Cathepsin L-like precursor 0.01 0.1963 0.2438
Echinococcus multilocularis cysteine protease 0.0145 0.3301 0.3301
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0145 0.3301 0.3301
Onchocerca volvulus 0.0145 0.3301 1
Onchocerca volvulus Cathepsin F homolog 0.0145 0.3301 1
Echinococcus granulosus cysteine protease 0.0079 0.1338 0.1338
Trypanosoma brucei cysteine peptidase C (CPC) 0.0118 0.249 0.7518
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.01 0.1963 0.5946
Leishmania major cathepsin L-like protease 0.0145 0.3301 1
Brugia malayi Cathepsin L-like precursor 0.0145 0.3301 0.41
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0145 0.3301 1
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0045 0.0342 0.0342
Plasmodium falciparum cysteine proteinase falcipain 2b 0.0145 0.3301 1
Trypanosoma cruzi cysteine peptidase, putative 0.0045 0.0342 0.0425
Entamoeba histolytica cysteine protease, putative 0.0079 0.1338 0.4054
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0145 0.3301 1
Entamoeba histolytica cysteine proteinase, putative 0.0145 0.3301 1
Echinococcus granulosus cathepsin l1 0.0145 0.3301 0.3301
Trypanosoma cruzi cysteine peptidase, putative 0.0145 0.3301 0.41
Echinococcus granulosus cathepsin L cysteine proteinase 0.0145 0.3301 0.3301
Brugia malayi Cathepsin L-like precursor 0.0145 0.3301 0.41
Echinococcus multilocularis importin subunit beta 1 0.0035 0.0034 0.0034
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0079 0.1338 0.3992
Giardia lamblia Cathepsin B precursor 0.0118 0.249 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0145 0.3301 1
Brugia malayi Cathepsin L-like precursor 0.0145 0.3301 0.41
Schistosoma mansoni SmCB2 peptidase (C01 family) 0.0306 0.8052 0.8052
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0145 0.3301 1
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.0118 0.249 0.3093
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0372 1 1
Entamoeba histolytica cysteine protease, putative 0.0079 0.1338 0.4054
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0145 0.3301 1
Entamoeba histolytica cysteine protease, putative 0.0145 0.3301 1
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0306 0.8052 0.8052
Entamoeba histolytica cysteine proteinase, putative 0.0079 0.1338 0.4054
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0145 0.3301 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0145 0.3301 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0145 0.3301 1
Onchocerca volvulus 0.0145 0.3301 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0145 0.3301 1
Brugia malayi Cathepsin L-like cysteine proteinase 0.01 0.1963 0.2438
Entamoeba histolytica cysteine proteinase, putative 0.0079 0.1338 0.4054
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0145 0.3301 1
Plasmodium vivax vivapain-2 0.0145 0.3301 1
Brugia malayi cathepsin L-like cysteine proteinase, identical 0.0045 0.0342 0.0425
Entamoeba histolytica cysteine proteinase 1, putative 0.0079 0.1338 0.4054
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0145 0.3301 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0079 0.1338 0.4054
Brugia malayi Papain family cysteine protease containing protein 0.0145 0.3301 0.41
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0145 0.3301 1
Brugia malayi cathepsin B-like cysteine proteinase 0.0306 0.8052 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0145 0.3301 1
Trypanosoma cruzi cysteine peptidase, putative 0.0079 0.1338 0.1662
Entamoeba histolytica cysteine protease, putative 0.0079 0.1338 0.4054
Brugia malayi Importin beta-1 subunit 0.0035 0.0034 0.0042
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0145 0.3301 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.0034 0.0034
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0145 0.3301 1
Schistosoma mansoni importin beta-1 0.0035 0.0034 0.0034
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0079 0.1338 0.1338
Onchocerca volvulus 0.0145 0.3301 1
Toxoplasma gondii HEAT repeat-containing protein 0.0035 0.0034 0.0103
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0145 0.3301 0.3301
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0145 0.3301 1
Schistosoma mansoni cathepsin s 0.0045 0.0342 0.0342
Entamoeba histolytica cysteine protease, putative 0.0079 0.1338 0.4054
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0145 0.3301 1
Leishmania major cathepsin L-like protease 0.0145 0.3301 1
Entamoeba histolytica cysteine protease, putative 0.0079 0.1338 0.4054
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0145 0.3301 1
Schistosoma mansoni cathepsin F (C01 family) 0.0145 0.3301 0.3301
Brugia malayi Cathepsin L-like precursor 0.0145 0.3301 0.41
Onchocerca volvulus 0.01 0.1963 0.5946
Entamoeba histolytica cysteine protease, putative 0.0079 0.1338 0.4054
Brugia malayi cathepsin L-like precursor 0.01 0.1963 0.2438
Entamoeba histolytica cysteine protease, putative 0.0079 0.1338 0.4054
Leishmania major cathepsin L-like protease 0.0145 0.3301 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0145 0.3301 1
Echinococcus multilocularis cathepsin b 0.0306 0.8052 0.8052
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0306 0.8052 0.8052
Plasmodium vivax unspecified product 0.0079 0.1338 0.4054
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0145 0.3301 0.3301
Plasmodium vivax vivapain-2 0.0145 0.3301 1
Plasmodium falciparum cysteine proteinase falcipain 2a 0.0145 0.3301 1
Plasmodium vivax unspecified product 0.0045 0.0342 0.1037
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0145 0.3301 0.3301
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0145 0.3301 1
Onchocerca volvulus Cathepsin L homolog 0.0145 0.3301 1
Plasmodium vivax vivapain-1 0.0079 0.1338 0.4054
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0145 0.3301 1
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0079 0.1338 0.1338
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.0306 0.8052 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0145 0.3301 1
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0079 0.1338 0.1338
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0145 0.3301 1
Trypanosoma cruzi cysteine peptidase, putative 0.0145 0.3301 0.41
Plasmodium falciparum cysteine proteinase falcipain 1 0.0079 0.1338 0.4054
Trypanosoma cruzi cysteine peptidase (N-terminal), putative 0.0079 0.1338 0.1662
Loa Loa (eye worm) hypothetical protein 0.01 0.1963 0.1963
Brugia malayi cathepsin F-like cysteine proteinase 0.0045 0.0342 0.0425
Echinococcus granulosus cathepsin l1 0.01 0.1963 0.1963
Echinococcus granulosus cathepsin b 0.0306 0.8052 0.8052
Loa Loa (eye worm) hypothetical protein 0.0045 0.0342 0.0342
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.01 0.1963 0.5946
Echinococcus granulosus importin subunit beta 1 0.0035 0.0034 0.0034
Echinococcus granulosus cathepsin l cysteine peptidase 0.0145 0.3301 0.3301
Schistosoma mansoni hypothetical protein 0.0372 1 1
Entamoeba histolytica cysteine protease, putative 0.0079 0.1338 0.4054
Echinococcus multilocularis cathepsin L 0.0079 0.1338 0.1338
Toxoplasma gondii cathepsin B 0.0118 0.249 0.7543
Echinococcus multilocularis cathepsin L cysteine protease 0.0145 0.3301 0.3301
Leishmania major cathepsin L-like protease 0.0145 0.3301 1
Leishmania major cathepsin L-like protease 0.0145 0.3301 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0145 0.3301 1
Toxoplasma gondii cathepsin CPL 0.0145 0.3301 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0145 0.3301 1
Onchocerca volvulus 0.0145 0.3301 1
Brugia malayi Papain family cysteine protease containing protein 0.0079 0.1338 0.1662
Echinococcus granulosus cathepsin b 0.0306 0.8052 0.8052
Leishmania major cathepsin L-like protease 0.0145 0.3301 1
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0118 0.249 0.249
Loa Loa (eye worm) fibroinase 0.0145 0.3301 0.3301
Trypanosoma cruzi cruzipain precursor, putative 0.0045 0.0342 0.0425
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0145 0.3301 1
Leishmania major cathepsin L-like protease 0.0145 0.3301 1
Trypanosoma cruzi cysteine proteinase, putative 0.0079 0.1338 0.1662
Brugia malayi Cathepsin L-like precursor 0.0145 0.3301 0.41
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0145 0.3301 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0145 0.3301 1
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.0118 0.249 0.7543
Plasmodium falciparum importin beta, putative 0.0035 0.0034 0.0103
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0145 0.3301 1
Echinococcus multilocularis cathepsin b 0.0306 0.8052 0.8052
Echinococcus granulosus cathepsin L cysteine protease 0.0079 0.1338 0.1338
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.01 0.1963 0.2438
Entamoeba histolytica cysteine protease, putative 0.0079 0.1338 0.4054
Entamoeba histolytica cysteine proteinase, putative 0.0079 0.1338 0.4054
Entamoeba histolytica cysteine protease, putative 0.0079 0.1338 0.4054
Loa Loa (eye worm) cysteine protease 0.0145 0.3301 0.3301

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 0.5012 um PUBCHEM_BIOASSAY: VP16 counterscreen qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 0.7079 um PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 6.3096 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b: Cytotox Counterscreen. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588855, AID588860] ChEMBL. No reference
Potency (functional) 8.9125 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Rango (Ran-regulated importin-beta cargo) - Importin beta complex formation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID540273] ChEMBL. No reference
Potency (functional) 25.1189 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Eta. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588636] ChEMBL. No reference
Potency (functional) = 89.1251 um PUBCHEM_BIOASSAY: qHTS Fluorescence Polarization Assay for Inhibitors of MLL CXXC domain - DNA interaction. (Class of assay: confirmatory) [Related pubchem assays: 2698 (Summary assay.)] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens 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.

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