TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 419.437 | Formula: C21H21N7O3
H donors: 1 H acceptors: 5 LogP: 1.85 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: CN1CCN([C@H](C1)c1onc(n1)c1ccc2c(c1)nn[nH]2)C(=O)COc1ccccc1
InChi: 1S/C21H21N7O3/c1-27-9-10-28(19(29)13-30-15-5-3-2-4-6-15)18(12-27)21-22-20(25-31-21)14-7-8-16-17(11-14)24-26-23-16/h2-8,11,18H,9-10,12-13H2,1H3,(H,23,24,26)/t18-/m1/s1
InChiKey: BATJJGHGYUSMPU-GOSISDBHSA-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

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	carnitine palmitoyltransferase 1A (liver)	Starlite/ChEMBL	No references
Rattus norvegicus	Carnitine palmitoyltransferase 1A	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Leishmania infantum	choline/Carnitine o-acyltransferase-like protein	Get druggable targets OG5_129191	All targets in OG5_129191
Echinococcus granulosus	carnitine O palmitoyltransferase 1 liver	Get druggable targets OG5_129191	All targets in OG5_129191
Echinococcus multilocularis	carnitine O palmitoyltransferase 1, liver	Get druggable targets OG5_129191	All targets in OG5_129191
Leishmania braziliensis	choline/Carnitine o-acyltransferase-like protein	Get druggable targets OG5_129191	All targets in OG5_129191
Leishmania major	choline/Carnitine o-acyltransferase-like protein	Get druggable targets OG5_129191	All targets in OG5_129191
Leishmania donovani	choline/Carnitine o-acyltransferase-like protein	Get druggable targets OG5_129191	All targets in OG5_129191
Trypanosoma cruzi	choline/carnitine O-acyltransferase, putative	Get druggable targets OG5_129191	All targets in OG5_129191
Leishmania mexicana	choline/Carnitine o-acyltransferase-like protein	Get druggable targets OG5_129191	All targets in OG5_129191
Trypanosoma cruzi	choline/carnitine O-acyltransferase, putative	Get druggable targets OG5_129191	All targets in OG5_129191
Brugia malayi	Choline/Carnitine o-acyltransferase family protein	Get druggable targets OG5_129191	All targets in OG5_129191
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_129191	All targets in OG5_129191

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Onchocerca volvulus		Carnitine palmitoyltransferase 1A	773 aa	758 aa	43.8 %
Candida albicans	similar to S. cerevisiae YAT2 putative carnitine O-acetyltransferase	Carnitine palmitoyltransferase 1A	773 aa	645 aa	25.6 %
Candida albicans	similar to S. cerevisiae YAT2 putative carnitine O-acetyltransferase	Carnitine palmitoyltransferase 1A	773 aa	645 aa	25.6 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Entamoeba histolytica	tyrosyl-DNA phosphodiesterase, putative	0.0072	0.0275	0.5507
Loa Loa (eye worm)	hypothetical protein	0.0059	0.0186	0.0186
Echinococcus multilocularis	caspase 3	0.0202	0.1114	0.6387
Trypanosoma brucei	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0072	0.0275	0.6104
Trypanosoma brucei	carnitine O-acetyltransferase, putative	0.0049	0.0125	0.2473
Onchocerca volvulus		0.0049	0.0125	0.2039
Trichomonas vaginalis	Clan CD, family C14, metacaspase-like cysteine peptidase	0.0097	0.0436	0.6463
Schistosoma mansoni	cercarial elastase (S01 family)	0.0059	0.0186	0.0496
Brugia malayi	Trypsin family protein	0.0059	0.0186	0.0186
Plasmodium falciparum	protein farnesyltransferase subunit alpha	0.0107	0.05	1
Echinococcus multilocularis	glycoprotein Antigen 5	0.0059	0.0186	0.1065
Schistosoma mansoni	jumonji domain containing protein	0.0064	0.0224	0.0597
Schistosoma mansoni	cercarial elastase (S01 family)	0.0059	0.0186	0.0496
Echinococcus granulosus	enteropeptidase	0.0059	0.0186	0.1065
Echinococcus multilocularis	caspase 3, apoptosis cysteine peptidase	0.0299	0.1745	1
Brugia malayi	Tyrosyl-DNA phosphodiesterase family protein	0.0072	0.0275	0.0275
Trypanosoma cruzi	choline/carnitine O-acyltransferase, putative	0.0269	0.1549	1
Mycobacterium ulcerans	hypothetical protein	0.0059	0.0186	0.5
Brugia malayi	Subtilase family protein	0.0607	0.3748	0.3748
Loa Loa (eye worm)	hypothetical protein	0.0059	0.0186	0.0186
Loa Loa (eye worm)	choline/Carnitine O-acyltransferase	0.0049	0.0125	0.0125
Echinococcus granulosus	transcription factor Dp 1	0.0042	0.0077	0.0443
Loa Loa (eye worm)	hypothetical protein	0.0097	0.0436	0.0436
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0059	0.0186	0.0496
Trypanosoma cruzi	metacaspase, putative	0.0097	0.0436	0.2706
Schistosoma mansoni	cercarial elastase (S01 family)	0.0059	0.0186	0.0496
Echinococcus granulosus	caspase 3 apoptosis cysteine peptidase	0.0299	0.1745	1
Trypanosoma brucei	carnitine O-palmitoyltransferase, putative	0.0049	0.0125	0.2473
Toxoplasma gondii	ICE family protease (caspase) p20 domain-containing protein	0.0097	0.0436	1
Brugia malayi	Trypsin-like protease protein 5	0.0059	0.0186	0.0186
Echinococcus granulosus	caspase 8	0.0097	0.0436	0.2498
Onchocerca volvulus	Prolyl endopeptidase homolog	0.0034	0.0023	0.0377
Loa Loa (eye worm)	hypothetical protein	0.0059	0.0186	0.0186
Trypanosoma cruzi	carnitine/choline acetyltransferase, putative	0.0049	0.0125	0.0669
Brugia malayi	jmjC domain containing protein	0.0064	0.0224	0.0224
Trypanosoma brucei	Metacaspase-4	0.0097	0.0436	1
Schistosoma mansoni	tripeptidyl-peptidase II (S08 family)	0.0607	0.3748	1
Loa Loa (eye worm)	subtilase	0.0607	0.3748	0.3748
Trypanosoma cruzi	metacaspase, putative	0.0097	0.0436	0.2706
Brugia malayi	hypothetical protein	0.0059	0.0186	0.0186
Schistosoma mansoni	caspase-7 (C14 family)	0.0125	0.0614	0.1638
Trypanosoma cruzi	choline/carnitine O-acyltransferase, putative	0.0049	0.0125	0.0669
Onchocerca volvulus		0.0049	0.0125	0.2039
Trichomonas vaginalis	conserved hypothetical protein	0.0097	0.0436	0.6463
Schistosoma mansoni	aminopeptidase PILS (M01 family)	0.0059	0.0186	0.0496
Echinococcus multilocularis	caspase 8	0.0097	0.0436	0.2498
Brugia malayi	mucosa associated lymphoid tissue lymphoma translocation protein 1	0.0097	0.0436	0.0436
Trypanosoma brucei	hypothetical protein, conserved	0.0049	0.0125	0.2473
Echinococcus multilocularis	protein farnesyltransferase alpha subunit	0.0107	0.05	0.2863
Echinococcus multilocularis	caspase 2	0.0125	0.0614	0.3519
Echinococcus multilocularis	Peptidase S8 S53, subtilisin kexin sedolisin	0.0227	0.1282	0.7345
Schistosoma mansoni	cercarial elastase (S01 family)	0.0059	0.0186	0.0496
Echinococcus multilocularis	lysine specific demethylase 5A	0.0064	0.0224	0.1283
Trichomonas vaginalis	Clan CD, family C14, metacaspase-like cysteine peptidase	0.0097	0.0436	0.6463
Echinococcus multilocularis	carnitine O palmitoyltransferase 2	0.0049	0.0125	0.0718
Brugia malayi	prolyl oligopeptidase family protein	0.0034	0.0023	0.0023
Onchocerca volvulus		0.0059	0.0186	0.3028
Echinococcus multilocularis	subfamily S1A unassigned peptidase (S01 family)	0.0059	0.0186	0.1065
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0059	0.0186	0.0496
Schistosoma mansoni	choline o-acyltransferase	0.0049	0.0125	0.0334
Toxoplasma gondii	hypothetical protein	0.0079	0.032	0.7182
Echinococcus granulosus	subfamily S1A unassigned peptidase S01 family	0.0059	0.0186	0.1065
Schistosoma mansoni	cercarial elastase (S01 family)	0.0059	0.0186	0.0496
Schistosoma mansoni	cercarial elastase (S01 family)	0.0059	0.0186	0.0496
Echinococcus multilocularis	choline O acetyltransferase	0.0049	0.0125	0.0718
Trypanosoma brucei	metacaspase 5, putative	0.0097	0.0436	1
Brugia malayi	Trypsin family protein	0.0059	0.0186	0.0186
Trypanosoma cruzi	metacaspase, putative	0.0097	0.0436	0.2706
Onchocerca volvulus		0.0059	0.0186	0.3028
Echinococcus multilocularis	enteropeptidase	0.0059	0.0186	0.1065
Brugia malayi	Trypsin family protein	0.0059	0.0186	0.0186
Onchocerca volvulus		0.0059	0.0186	0.3028
Brugia malayi	Choline O-acetyltransferase	0.0049	0.0125	0.0125
Trypanosoma cruzi	hypothetical protein, conserved	0.0049	0.0125	0.0669
Echinococcus granulosus	Transcription factor JmjC domain containing protein	0.0064	0.0224	0.1283
Trypanosoma cruzi	hypothetical protein, conserved	0.0049	0.0125	0.0669
Toxoplasma gondii	ICE family protease (caspase) p20 domain-containing protein	0.0097	0.0436	1
Schistosoma mansoni	cercarial elastase (S01 family)	0.0059	0.0186	0.0496
Echinococcus multilocularis	transmembrane protease serine 3	0.0059	0.0186	0.1065
Trypanosoma brucei	metacaspase MCA3	0.0097	0.0436	1
Onchocerca volvulus		0.0049	0.0125	0.2039
Plasmodium vivax	prenyltransferase alpha subunit, putative	0.0107	0.05	1
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0064	0.0224	0.0597
Echinococcus granulosus	caspase	0.0299	0.1745	1
Trypanosoma cruzi	hypothetical protein, conserved	0.0049	0.0125	0.0669
Trypanosoma brucei	carnitine O-palmitoyltransferase II, putative	0.0049	0.0125	0.2473
Trichomonas vaginalis	Clan CD, family C14, metacaspase-like cysteine peptidase	0.0097	0.0436	0.6463
Schistosoma mansoni	cercarial elastase (S01 family)	0.0059	0.0186	0.0496
Schistosoma mansoni	hypothetical protein	0.0059	0.0186	0.0496
Brugia malayi	Protein prenyltransferase alpha subunit repeat containing protein	0.0107	0.05	0.05
Trichomonas vaginalis	conserved hypothetical protein	0.0097	0.0436	0.6463
Schistosoma mansoni	choline o-acyltransferase	0.0049	0.0125	0.0334
Loa Loa (eye worm)	tyrosyl-DNA phosphodiesterase	0.0072	0.0275	0.0275
Trypanosoma cruzi	hypothetical protein, conserved	0.0049	0.0125	0.0669
Trypanosoma cruzi	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0072	0.0275	0.1652
Trichomonas vaginalis	Clan CD, family C14, metacaspase-like cysteine peptidase	0.0097	0.0436	0.6463
Onchocerca volvulus		0.0059	0.0186	0.3028
Schistosoma mansoni	subfamily C14A unassigned peptidase (C14 family)	0.0097	0.0436	0.1163
Onchocerca volvulus		0.0059	0.0186	0.3028
Schistosoma mansoni	cercarial elastase (S01 family)	0.0059	0.0186	0.0496
Trichomonas vaginalis	Clan CD, family C14, metacaspase-like cysteine peptidase	0.0097	0.0436	0.6463
Brugia malayi	Chymotrypsin-like protease CTRL-1 precursor	0.0059	0.0186	0.0186
Brugia malayi	jmjC domain containing protein	0.0064	0.0224	0.0224
Trichomonas vaginalis	protein farnesyltransferase alpha subunit, putative	0.0107	0.05	1
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0059	0.0186	0.0496
Echinococcus multilocularis	Peptidase S1 S6, chymotrypsin Hap	0.0059	0.0186	0.1065
Onchocerca volvulus		0.0049	0.0125	0.2039
Loa Loa (eye worm)	STAT protein	0.1571	1	1
Echinococcus multilocularis	tyrosyl DNA phosphodiesterase 1	0.0072	0.0275	0.1577
Loa Loa (eye worm)	hypothetical protein	0.0473	0.2875	0.2875
Brugia malayi	Cell death protein 3 precursor	0.0125	0.0614	0.0614
Schistosoma mansoni	tyrosyl-DNA phosphodiesterase	0.0072	0.0275	0.0734
Brugia malayi	Choline/Carnitine o-acyltransferase family protein	0.0049	0.0125	0.0125
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0023	0.0023
Loa Loa (eye worm)	hypothetical protein	0.0107	0.05	0.05
Echinococcus granulosus	lysine specific demethylase 5A	0.0064	0.0224	0.1283
Echinococcus granulosus	glycoprotein Antigen 5	0.0059	0.0186	0.1065
Toxoplasma gondii	ICE family protease (caspase) p20 domain-containing protein	0.0097	0.0436	1
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0059	0.0186	0.0496
Brugia malayi	Choline O-acetyltransferase	0.0049	0.0125	0.0125
Trypanosoma cruzi	choline/carnitine O-acetyltransferase, putative	0.0049	0.0125	0.0669
Echinococcus granulosus	choline O acetyltransferase	0.0049	0.0125	0.0718
Onchocerca volvulus		0.0059	0.0186	0.3028
Giardia lamblia	Rab geranylgeranyltransferase	0.0107	0.05	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0097	0.0436	0.6463
Echinococcus granulosus	carnitine O palmitoyltransferase 1 liver	0.0269	0.1549	0.8877
Echinococcus granulosus	transmembrane protease serine 3	0.0059	0.0186	0.1065
Echinococcus granulosus	protein farnesyltransferase alpha subunit	0.0107	0.05	0.2863
Trichomonas vaginalis	Clan CD, family C14, metacaspase-like cysteine peptidase	0.0097	0.0436	0.6463
Echinococcus multilocularis	transcription factor Dp 1	0.0042	0.0077	0.0443
Brugia malayi	Choline/Carnitine o-acyltransferase family protein	0.0049	0.0125	0.0125
Mycobacterium tuberculosis	Probable protease II PtrBa [first part] (oligopeptidase B)	0.003	0	0.5
Leishmania major	tyrosyl-DNA phosphodiesterase 1	0.0072	0.0275	0.1652
Trichomonas vaginalis	Clan CD, family C14, metacaspase-like cysteine peptidase	0.0097	0.0436	0.6463
Loa Loa (eye worm)	jmjC domain-containing protein	0.0064	0.0224	0.0224
Loa Loa (eye worm)	carnitine O-palmitoyltransferase I isoform	0.0049	0.0125	0.0125
Leishmania major	metacaspase, putative	0.0097	0.0436	0.2706
Schistosoma mansoni	prolyl oligopeptidase (S09 family)	0.0034	0.0023	0.0062
Trypanosoma brucei	carnitine O-palmitoyltransferase II, putative	0.0049	0.0125	0.2473
Loa Loa (eye worm)	prenyltransferase alpha subunit repeat containing protein	0.0107	0.05	0.05
Echinococcus multilocularis	carnitine O palmitoyltransferase 1, liver	0.0269	0.1549	0.8877
Loa Loa (eye worm)	hypothetical protein	0.0059	0.0186	0.0186
Trypanosoma cruzi	choline/carnitine O-acyltransferase, putative	0.0269	0.1549	1
Loa Loa (eye worm)	hypothetical protein	0.0059	0.0186	0.0186
Loa Loa (eye worm)	hypothetical protein	0.0049	0.0125	0.0125
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0059	0.0186	0.0496
Echinococcus granulosus	Peptidase S1 S6 chymotrypsin Hap	0.0059	0.0186	0.1065
Onchocerca volvulus	Cell death protein 3 homolog	0.0125	0.0614	1
Echinococcus multilocularis	Mastin	0.0059	0.0186	0.1065
Trypanosoma cruzi	hypothetical protein, conserved	0.0049	0.0125	0.0669
Trichomonas vaginalis	protein farnesyltransferase alpha subunit, putative	0.0107	0.05	1
Schistosoma mansoni	cercarial elastase (S01 family)	0.0059	0.0186	0.0496
Trypanosoma cruzi	metacaspase 5, putative	0.0097	0.0436	0.2706
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0064	0.0224	0.0597
Schistosoma mansoni	protein farnesyltransferase alpha subunit	0.0107	0.05	0.1333
Echinococcus granulosus	caspase 3	0.0202	0.1114	0.6387
Loa Loa (eye worm)	hypothetical protein	0.0059	0.0186	0.0186
Brugia malayi	Trypsin family protein	0.0059	0.0186	0.0186
Schistosoma mansoni	cercarial elastase (S01 family)	0.0059	0.0186	0.0496
Schistosoma mansoni	caspase-3 (C14 family)	0.0299	0.1745	0.4655
Trypanosoma cruzi	carnitine O-palmitoyltransferase II, putative	0.0049	0.0125	0.0669
Trichomonas vaginalis	Clan CD, family C14, metacaspase-like cysteine peptidase	0.0097	0.0436	0.6463
Trichomonas vaginalis	conserved hypothetical protein	0.0097	0.0436	0.6463
Schistosoma mansoni	hypothetical protein	0.0059	0.0186	0.0496
Echinococcus multilocularis	Transcription factor, JmjC domain containing protein	0.0064	0.0224	0.1283
Echinococcus granulosus	prolyl endopeptidase	0.0034	0.0023	0.0133
Leishmania major	choline/Carnitine o-acyltransferase-like protein	0.0269	0.1549	1
Echinococcus granulosus	peptidase s8 s53 subtilisin kexin sedolisin	0.0227	0.1282	0.7345
Echinococcus granulosus	caspase 2	0.0125	0.0614	0.3519
Echinococcus granulosus	Mastin	0.0059	0.0186	0.1065
Trypanosoma cruzi	metacaspase, putative	0.0097	0.0436	0.2706
Trypanosoma cruzi	carnitine O-acetyltransferase, putative	0.0049	0.0125	0.0669
Loa Loa (eye worm)	hypothetical protein	0.0125	0.0614	0.0614
Schistosoma mansoni	caspase-7 (C14 family)	0.0299	0.1745	0.4655
Echinococcus granulosus	tyrosyl DNA phosphodiesterase 1	0.0072	0.0275	0.1577
Trichomonas vaginalis	protein farnesyltransferase alpha subunit/RAB geranylgeranyl transferase alpha subunit, putative	0.0107	0.05	1
Echinococcus granulosus	carnitine O palmitoyltransferase 2	0.0049	0.0125	0.0718
Loa Loa (eye worm)	hypothetical protein	0.0059	0.0186	0.0186
Trichomonas vaginalis	Clan CD, family C14, metacaspase-like cysteine peptidase	0.0097	0.0436	0.6463
Echinococcus multilocularis	prolyl endopeptidase	0.0034	0.0023	0.0133
Brugia malayi	Choline/Carnitine o-acyltransferase family protein	0.0473	0.2875	0.2875
Trypanosoma cruzi	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0072	0.0275	0.1652
Echinococcus multilocularis	caspase	0.0299	0.1745	1
Trypanosoma brucei	metacaspase MCA2	0.0097	0.0436	1
Loa Loa (eye worm)	trypsin family protein	0.0059	0.0186	0.0186
Trichomonas vaginalis	conserved hypothetical protein	0.0097	0.0436	0.6463
Entamoeba histolytica	protein farnesyltransferase alpha subunit, putative	0.0107	0.05	1
Trichomonas vaginalis	conserved hypothetical protein	0.0097	0.0436	0.6463
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0059	0.0186	0.0496
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0059	0.0186	0.0496
Trypanosoma cruzi	metacaspase 5, putative	0.0097	0.0436	0.2706
Leishmania major	carnitine palmitoyltransferase-like protein	0.0049	0.0125	0.0669
Loa Loa (eye worm)	choline O-acetyltransferase	0.0049	0.0125	0.0125
Trypanosoma cruzi	carnitine/choline acetyltransferase, putative	0.0049	0.0125	0.0669
Trypanosoma brucei	metacaspase	0.0097	0.0436	1
Leishmania major	carnitine/choline acetyltransferase, putative	0.0049	0.0125	0.0669
Schistosoma mansoni	prolyl oligopeptidase (S09 family)	0.0034	0.0023	0.0062

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 0.0246 uM	SUPPLEMENTARY: Inhibition of Carnitine palmitoyltransferase 1, liver isoform	ChEMBL.	No reference
IC50 (binding)	= 0.265 uM	SUPPLEMENTARY	SUPPLEMENTARY.	No reference
IC50 (binding)	> 100 uM	SUPPLEMENTARY: Inhibition of Carnitine palmitoyltransferase 1, muscle isoform	ChEMBL.	No reference
IC50 (binding)	> 100 uM	SUPPLEMENTARY: Inhibition of Carnitine palmitoyltransferase 2	ChEMBL.	No reference
IC50 (binding)	> 100 uM	SUPPLEMENTARY	SUPPLEMENTARY.	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: CHEMBL3431560

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 1922152