TDR Targets

Basic information

Technical information

TDR Targets ID: 1448507
Name: N-(3-acetylphenyl)-2-[2-oxo-3-[2-(propanoylam ino)phenyl]quinoxalin-1-yl]butanamide
MW: 496.557 | Formula: C29H28N4O4
H donors: 2 H acceptors: 4 LogP: 3.7 Rotable bonds: 10
Rule of 5 violations (Lipinski): 1
SMILES: CCC(=O)Nc1ccccc1c1nc2ccccc2n(c1=O)C(C(=O)Nc1cccc(c1)C(=O)C)CC
InChi: 1S/C29H28N4O4/c1-4-24(28(36)30-20-12-10-11-19(17-20)18(3)34)33-25-16-9-8-15-23(25)32-27(29(33)37)21-13-6-7-14-22(21)31-26(35)5-2/h6-17,24H,4-5H2,1-3H3,(H,30,36)(H,31,35)
InChiKey: DAZZSHPTJIDNLZ-UHFFFAOYSA-N

Network

Hover on a compound node to display the structore

Target Layer

Model Organisms

Species	Viewmode
Arabidopsis thaliana
Caenorhabditis elegans
Dictyostelium discoideum
Drosophila melanogaster
Escherichia coli
Homo sapiens
Mus musculus
Oryza sativa
Saccharomyces cerevisiae
Schmidtea mediterranea
Other organisms

TDR Pathogens:

Species	Viewmode
Brugia malayi
Chlamydia trachomatis
Echinococcus granulosus
Entamoeba histolytica
Echinococcus multilocularis
Giardia lamblia
Leishmania major
Loa Loa (eye worm)
Mycobacterium leprae
Mycobacterium tuberculosis
Mycobacterium ulcerans
Onchocerca volvulus
Plasmodium falciparum
Plasmodium vivax
Schistosoma mansoni
Trypanosoma brucei
Trypanosoma cruzi
Toxoplasma gondii
Treponema pallidum
Trichomonas vaginalis
Wolbachia endosymbiont of Brugia malayi

Other Pathogens:

Species	Viewmode
Babesia bovis
Candida albicans
Cryptosporidium hominis
Cryptosporidium parvum
Leishmania braziliensis
Leishmania donovani
Leishmania infantum
Leishmania mexicana
Neospora caninum
Plasmodium berghei
Plasmodium knowlesi
Plasmodium yoelii
Schistosoma japonicum
Trypanosoma brucei gambiense
Trypanosoma congolense
Theileria parva

Compound Layer

This is a work in progress. Come back soon to try this features!

Clustering layers

This is a work in progress. Come back soon to try this features!

Synonyms

N-(3-acetylphenyl)-2-[2-oxo-3-[2-(1-oxopropylamino)phenyl]-1-quinoxalinyl]butanamide
N-(3-acetylphenyl)-2-[2-keto-3-(2-propionamidophenyl)quinoxalin-1-yl]butyramide
N-(3-ethanoylphenyl)-2-[2-oxo-3-[2-(propanoylamino)phenyl]quinoxalin-1-yl]butanamide
D384-0189
NCGC00119612-01

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	apolipoprotein B mRNA editing enzyme, catalytic polypeptide-like 3G	Starlite/ChEMBL	No references
Homo sapiens	apolipoprotein B mRNA editing enzyme, catalytic polypeptide-like 3D	Starlite/ChEMBL	No references
Homo sapiens	SMAD family member 2	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Loa Loa (eye worm)	MH2 domain-containing protein	Get druggable targets OG5_131716	All targets in OG5_131716
Loa Loa (eye worm)	transcription factor SMAD2	Get druggable targets OG5_131716	All targets in OG5_131716
Brugia malayi	MH2 domain containing protein	Get druggable targets OG5_131716	All targets in OG5_131716

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Brugia malayi	MH2 domain containing protein	SMAD family member 2	467 aa	405 aa	31.6 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Loa Loa (eye worm)	hypothetical protein	0.0153	0.0123	0.0123
Loa Loa (eye worm)	hypothetical protein	0.0553	0.5996	0.5996
Giardia lamblia	Cathepsin L precursor	0.0153	0.0123	0.5
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0827	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0827	1	1
Loa Loa (eye worm)	ctsf protein	0.0827	1	1
Schistosoma mansoni	cathepsin F (C01 family)	0.0827	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0827	1	1
Brugia malayi	fibroinase precursor	0.0153	0.0123	0.0123
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0827	1	1
Onchocerca volvulus		0.0827	1	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0827	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0827	1	1
Schistosoma mansoni	cathepsin F (C01 family)	0.0827	1	1
Giardia lamblia	Cathepsin B precursor	0.0153	0.0123	0.5
Onchocerca volvulus		0.0365	0.3235	0.3151
Brugia malayi	hypothetical protein	0.0365	0.3235	0.3235
Echinococcus granulosus	cysteine protease	0.0426	0.4127	0.4054
Giardia lamblia	Cathepsin L-like protease	0.0153	0.0123	0.5
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0827	1	1
Brugia malayi	cathepsin Z-like cysteine proteinase	0.0153	0.0123	0.0123
Entamoeba histolytica	cysteine protease, putative	0.0426	0.4127	0.4054
Onchocerca volvulus		0.0827	1	1
Loa Loa (eye worm)	cysteine proteinase cathepsin Z	0.0153	0.0123	0.0123
Giardia lamblia	Cathepsin B precursor	0.0153	0.0123	0.5
Onchocerca volvulus		0.0827	1	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0827	1	1
Leishmania major	cathepsin L-like protease	0.0827	1	1
Loa Loa (eye worm)	hypothetical protein	0.0153	0.0123	0.0123
Giardia lamblia	Cathepsin L precursor	0.0153	0.0123	0.5
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0553	0.5996	0.5996
Leishmania major	cathepsin L-like protease	0.0827	1	1
Giardia lamblia	Cathepsin B precursor	0.0153	0.0123	0.5
Giardia lamblia	Cathepsin L precursor	0.0153	0.0123	0.5
Entamoeba histolytica	cysteine proteinase, putative	0.0426	0.4127	0.4054
Brugia malayi	cathepsin F-like cysteine proteinase	0.0273	0.1892	0.1892
Brugia malayi	cathepsin L precursor	0.0153	0.0123	0.0123
Entamoeba histolytica	cysteine protease, putative	0.0426	0.4127	0.4054
Trypanosoma cruzi	cysteine peptidase, putative	0.0273	0.1892	0.1791
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0827	1	1
Brugia malayi	Cathepsin L-like precursor	0.0553	0.5996	0.5996
Echinococcus multilocularis	cysteine protease	0.0827	1	1
Brugia malayi	cathepsin Z-like cysteine proteinase	0.0153	0.0123	0.0123
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0827	1	1
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0553	0.5996	0.5946
Trypanosoma cruzi	cysteine peptidase, putative	0.0827	1	1
Giardia lamblia	Cysteine protease	0.0153	0.0123	0.5
Giardia lamblia	Cathepsin B precursor	0.0153	0.0123	0.5
Brugia malayi	Papain family cysteine protease containing protein	0.0827	1	1
Brugia malayi	Papain family cysteine protease containing protein	0.0153	0.0123	0.0123
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0827	1	1
Echinococcus multilocularis	cathepsin L	0.0426	0.4127	0.4054
Onchocerca volvulus		0.0827	1	1
Giardia lamblia	Encystation-specific protease	0.0153	0.0123	0.5
Trypanosoma cruzi	cruzipain precursor, putative	0.0827	1	1
Loa Loa (eye worm)	hypothetical protein	0.0827	1	1
Entamoeba histolytica	cysteine protease, putative	0.0426	0.4127	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0553	0.5996	0.5946
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.0426	0.4127	0.4054
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0827	1	1
Echinococcus multilocularis	cathepsin L cysteine protease	0.0827	1	1
Giardia lamblia	Hypothetical protein	0.0153	0.0123	0.5
Brugia malayi	Cathepsin L-like precursor	0.0273	0.1892	0.1892
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0273	0.1892	0.1892
Giardia lamblia	Cysteine protease	0.0153	0.0123	0.5
Leishmania major	cathepsin L-like protease	0.0827	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0827	1	1
Loa Loa (eye worm)	hypothetical protein	0.0273	0.1892	0.1892
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0827	1	1
Entamoeba histolytica	cysteine proteinase, putative	0.0426	0.4127	0.4054
Leishmania major	cathepsin L-like protease	0.0827	1	1
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0426	0.4127	0.4054
Echinococcus multilocularis	cysteine protease	0.0827	1	1
Entamoeba histolytica	cysteine protease, putative	0.0426	0.4127	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0827	1	1
Loa Loa (eye worm)	fibroinase	0.0827	1	1
Brugia malayi	cathepsin B-like cysteine proteinase	0.0153	0.0123	0.0123
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0827	1	1
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0153	0.0123	0.0123
Toxoplasma gondii	cathepsin CPL	0.0827	1	1
Plasmodium vivax	vivapain-2	0.0827	1	1
Brugia malayi	cathepsin L-like cysteine proteinase	0.0153	0.0123	0.0123
Entamoeba histolytica	cysteine proteinase, putative	0.0426	0.4127	0.4054
Entamoeba histolytica	cysteine protease, putative	0.0426	0.4127	0.4054
Schistosoma mansoni	cathepsin F (C01 family)	0.0553	0.5996	0.5946
Brugia malayi	Cathepsin L-like precursor	0.0827	1	1
Entamoeba histolytica	cysteine protease, putative	0.0827	1	1
Leishmania major	cathepsin L-like protease	0.0827	1	1
Brugia malayi	Cathepsin L-like precursor	0.0827	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0827	1	1
Loa Loa (eye worm)	cathepsin B	0.0153	0.0123	0.0123
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0426	0.4127	0.4054
Plasmodium vivax	vivapain-2	0.0827	1	1
Brugia malayi	Papain family cysteine protease containing protein	0.0153	0.0123	0.0123
Giardia lamblia	Cathepsin B precursor	0.0153	0.0123	0.5
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0827	1	1
Loa Loa (eye worm)	hypothetical protein	0.0153	0.0123	0.0123
Onchocerca volvulus	Cathepsin L homolog	0.0827	1	1
Leishmania major	cathepsin L-like protease	0.0827	1	1
Loa Loa (eye worm)	hypothetical protein	0.0553	0.5996	0.5996
Entamoeba histolytica	cysteine proteinase 2	0.0426	0.4127	0.4054
Brugia malayi	Cathepsin L-like precursor	0.0827	1	1
Plasmodium vivax	unspecified product	0.0426	0.4127	0.4054
Entamoeba histolytica	cysteine proteinase, putative	0.0827	1	1
Schistosoma mansoni	cathepsin s	0.0273	0.1892	0.1791
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0827	1	1
Onchocerca volvulus		0.0827	1	1
Loa Loa (eye worm)	hypothetical protein	0.0553	0.5996	0.5996
Loa Loa (eye worm)	hypothetical protein	0.0153	0.0123	0.0123
Brugia malayi	Cathepsin L-like precursor	0.0827	1	1
Giardia lamblia	Dipeptidyl-peptidase I precursor	0.0153	0.0123	0.5
Entamoeba histolytica	cysteine protease, putative	0.0426	0.4127	0.4054
Entamoeba histolytica	cysteine protease, putative	0.0426	0.4127	0.4054
Loa Loa (eye worm)	hypothetical protein	0.0153	0.0123	0.0123
Onchocerca volvulus		0.0827	1	1
Leishmania major	cathepsin L-like protease	0.0827	1	1
Brugia malayi	Papain family cysteine protease containing protein	0.0426	0.4127	0.4127
Giardia lamblia	Dipeptidyl-peptidase I precursor	0.0153	0.0123	0.5
Entamoeba histolytica	cysteine protease, putative	0.0426	0.4127	0.4054
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0827	1	1
Giardia lamblia	Cathepsin L precursor	0.0153	0.0123	0.5
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0827	1	1
Entamoeba histolytica	cysteine proteinase, putative	0.0426	0.4127	0.4054
Entamoeba histolytica	cysteine protease, putative	0.0426	0.4127	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0426	0.4127	0.4054
Brugia malayi	cathepsin L-like cysteine proteinase, identical	0.0273	0.1892	0.1892
Brugia malayi	Papain family cysteine protease containing protein	0.0153	0.0123	0.0123
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0827	1	1
Loa Loa (eye worm)	cysteine protease	0.0827	1	1
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0827	1	1
Entamoeba histolytica	cysteine proteinase, putative	0.0827	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0827	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0827	1	1
Entamoeba histolytica	cysteine protease, putative	0.0426	0.4127	0.4054
Onchocerca volvulus		0.0827	1	1
Entamoeba histolytica	cysteine protease, putative	0.0426	0.4127	0.4054
Trypanosoma cruzi	cysteine proteinase, putative	0.0426	0.4127	0.4054
Loa Loa (eye worm)	hypothetical protein	0.0273	0.1892	0.1892
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0426	0.4127	0.4054
Brugia malayi	cathepsin L-like precursor	0.0553	0.5996	0.5996
Trypanosoma cruzi	cysteine peptidase, putative	0.0827	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0827	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0827	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0827	1	1
Giardia lamblia	Hypothetical protein	0.0153	0.0123	0.5
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.0827	1	1
Giardia lamblia	Cysteine protease	0.0153	0.0123	0.5
Giardia lamblia	Cathepsin L-like protease	0.0153	0.0123	0.5
Giardia lamblia	Cathepsin L precursor	0.0153	0.0123	0.5
Trypanosoma cruzi	cruzipain precursor, putative	0.0273	0.1892	0.1791
Loa Loa (eye worm)	hypothetical protein	0.0153	0.0123	0.0123
Giardia lamblia	Cathepsin B precursor	0.0153	0.0123	0.5
Giardia lamblia	Cathepsin L precursor	0.0153	0.0123	0.5
Entamoeba histolytica	cysteine protease, putative	0.0426	0.4127	0.4054
Trypanosoma cruzi	cysteine protease, putative	0.0426	0.4127	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0827	1	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0827	1	1
Plasmodium falciparum	cysteine proteinase falcipain 1	0.0426	0.4127	0.4054
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0827	1	1
Echinococcus granulosus	cathepsin l1	0.0553	0.5996	0.5946
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0827	1	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0426	0.4127	0.4054
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0827	1	1
Onchocerca volvulus		0.0553	0.5996	0.5946
Plasmodium vivax	vivapain-3	0.0426	0.4127	0.4054
Giardia lamblia	Cathepsin B-like cysteine proteinase 3 precursor	0.0153	0.0123	0.5
Brugia malayi	cathepsin F-like cysteine proteinase	0.0153	0.0123	0.0123
Trypanosoma cruzi	cysteine peptidase, putative	0.0827	1	1
Brugia malayi	Papain family cysteine protease containing protein	0.0426	0.4127	0.4127
Leishmania major	cathepsin L-like protease	0.0827	1	1
Entamoeba histolytica	cysteine protease, putative	0.0426	0.4127	0.4054
Entamoeba histolytica	cysteine proteinase, putative	0.0553	0.5996	0.5946
Echinococcus multilocularis	cathepsin L cysteine protease	0.0827	1	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0827	1	1
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0426	0.4127	0.4054
Giardia lamblia	Cathepsin B precursor	0.0153	0.0123	0.5
Trypanosoma cruzi	cysteine proteinase, putative	0.0426	0.4127	0.4054
Giardia lamblia	Cathepsin B precursor	0.0153	0.0123	0.5
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0827	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0827	1	1
Loa Loa (eye worm)	hypothetical protein	0.0365	0.3235	0.3235
Echinococcus granulosus	cathepsin l1	0.0827	1	1
Loa Loa (eye worm)	hypothetical protein	0.0273	0.1892	0.1892
Echinococcus granulosus	cathepsin L cysteine protease	0.0426	0.4127	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0827	1	1
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0153	0.0123	0.0123
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0827	1	1
Brugia malayi	cahepsin L-like non-peptiedase homolog	0.0153	0.0123	0.0123
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0827	1	1
Plasmodium vivax	vivapain-1	0.0426	0.4127	0.4054
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0827	1	1
Giardia lamblia	Cysteine protease	0.0153	0.0123	0.5
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0426	0.4127	0.4054
Plasmodium vivax	unspecified product	0.0273	0.1892	0.1791
Onchocerca volvulus	Cathepsin F homolog	0.0827	1	1
Brugia malayi	Cathepsin L-like precursor	0.0553	0.5996	0.5996
Brugia malayi	Cathepsin L-like precursor	0.0827	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0827	1	1
Leishmania major	cysteine peptidase A (CPA)	0.0827	1	1
Echinococcus granulosus	cathepsin L	0.0426	0.4127	0.4054
Entamoeba histolytica	cysteine proteinase 1, putative	0.0426	0.4127	0.4054
Onchocerca volvulus	Cathepsin L homolog	0.0827	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0426	0.4127	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0553	0.5996	0.5946
Plasmodium falciparum	cysteine proteinase falcipain 3	0.0827	1	1
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0827	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0827	1	1
Loa Loa (eye worm)	hypothetical protein	0.0153	0.0123	0.0123
Giardia lamblia	Dipeptidyl-peptidase I precursor	0.0153	0.0123	0.5
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.0827	1	1

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	10 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588856, AID588860]	ChEMBL.	No reference
Potency (functional)	14.1254 uM	PubChem BioAssay. qHTS for Inhibitors of Vif-A3G Interactions: qHTS. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	15.8489 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of Vif-A3F Interactions: qHTS. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	29.0929 uM	PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648]	ChEMBL.	No reference
Potency (functional)	= 35.4813 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of DNA Polymerase Beta. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	35.4813 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
Potency (functional)	89.1251 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391]	ChEMBL.	No reference
Potency (functional)	89.1251 uM	PubChem BioAssay. qHTS Assay to Find Inhibitors of Pin1. (Class of assay: confirmatory)	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

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

ChEMBL: CHEMBL1589991

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.

Detailed information for compound 1448507