TDR Targets

Basic information

Technical information

TDR Targets ID: 1205834
Name: N-[4-[2-hydroxy-3-[2-(hydroxymethyl)benzimida zol-1-yl]propoxy]phenyl]acetamide
MW: 355.388 | Formula: C19H21N3O4
H donors: 3 H acceptors: 4 LogP: 0.75 Rotable bonds: 8
Rule of 5 violations (Lipinski): 1
SMILES: OCc1nc2c(n1CC(COc1ccc(cc1)NC(=O)C)O)cccc2
InChi: 1S/C19H21N3O4/c1-13(24)20-14-6-8-16(9-7-14)26-12-15(25)10-22-18-5-3-2-4-17(18)21-19(22)11-23/h2-9,15,23,25H,10-12H2,1H3,(H,20,24)
InChiKey: MLXBPVHHWNIVEX-UHFFFAOYSA-N

Network

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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

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Clustering layers

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Synonyms

N-[4-[2-hydroxy-3-[2-(hydroxymethyl)-1-benzimidazolyl]propoxy]phenyl]acetamide
N-[4-[2-hydroxy-3-(2-methylolbenzimidazol-1-yl)propoxy]phenyl]acetamide
N-[4-[2-hydroxy-3-[2-(hydroxymethyl)benzimidazol-1-yl]propoxy]phenyl]ethanamide
MLS000765762
SMR000278868
BAS 10791320

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	GNAS complex locus	Starlite/ChEMBL	No references
Homo sapiens	geminin, DNA replication inhibitor	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 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
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
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	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
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	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

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Brugia malayi	Hypothetical 65.5 kDa Trp-Asp repeats containing protein F02E8.5 inchromosome X	geminin, DNA replication inhibitor	209 aa	176 aa	27.8 %
Schistosoma mansoni	GTP-binding protein alpha subunit gna	GNAS complex locus	394 aa	450 aa	28.7 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Toxoplasma gondii	ABC1 family protein	0.0037	0.0918	0.4208
Schistosoma mansoni	methyl-cpg binding protein mbd	0.0018	0.0061	0.0071
Brugia malayi	Thioredoxin reductase	0.0048	0.1446	0.3004
Brugia malayi	Bromodomain containing protein	0.0041	0.1093	0.2271
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0037	0.0918	0.1907
Schistosoma mansoni	methyl-cpg binding protein mbd	0.0018	0.0061	0.0071
Schistosoma mansoni	aldehyde dehydrogenase	0.0064	0.2182	0.2533
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0037	0.0918	0.1066
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.0019	0.0113	0.0132
Loa Loa (eye worm)	beta-lactamase	0.0037	0.0918	0.1803
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0918	0.1803
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0025	0.0374	0.1713
Mycobacterium leprae	conserved hypothetical protein	0.0037	0.0918	0.1218
Schistosoma mansoni	aldehyde dehydrogenase	0.0064	0.2182	0.2533
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0918	0.1803
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.1765	0.2049
Plasmodium vivax	thioredoxin reductase, putative	0.0048	0.1446	1
Mycobacterium ulcerans	acyl-CoA synthetase	0.0025	0.0374	0.1713
Brugia malayi	AMP-binding enzyme family protein	0.0025	0.0374	0.0776
Mycobacterium tuberculosis	Probable reductase	0.011	0.4282	0.4282
Schistosoma mansoni	hypothetical protein	0.0022	0.0235	0.0273
Trypanosoma brucei	trypanothione reductase	0.0048	0.1446	1
Brugia malayi	beta-lactamase	0.0037	0.0918	0.1907
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	0.0019	0.0113	0.0784
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.0019	0.0113	0.0132
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0064	0.2182	1
Trypanosoma cruzi	hypothetical protein, conserved	0.0037	0.0918	0.6349
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0025	0.0374	0.1713
Schistosoma mansoni	bromodomain containing protein	0.0067	0.2307	0.2678
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0055	0.1765	0.3666
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0018	0.0039	0.0039
Leishmania major	hypothetical protein, conserved	0.0037	0.0918	0.4208
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0018	0.0061	0.0071
Onchocerca volvulus	Huntingtin homolog	0.0122	0.4815	1
Schistosoma mansoni	ap endonuclease	0.0019	0.0113	0.0132
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0019	0.0085	0.0085
Schistosoma mansoni	hypothetical protein	0.0205	0.8615	1
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0019	0.0113	0.0109
Trichomonas vaginalis	D-aminoacylase, putative	0.0037	0.0918	1
Trichomonas vaginalis	penicillin-binding protein, putative	0.0037	0.0918	1
Loa Loa (eye worm)	bromodomain containing protein	0.0019	0.0091	0.0063
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0037	0.0918	0.4208
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0048	0.1446	0.1679
Loa Loa (eye worm)	glutathione reductase	0.0048	0.1446	0.2913
Brugia malayi	exodeoxyribonuclease III family protein	0.0019	0.0113	0.0235
Brugia malayi	glutathione reductase	0.0048	0.1446	0.3004
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.0038	0.0978	0.1136
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0085	0.0051
Brugia malayi	AMP-binding enzyme family protein	0.0025	0.0374	0.0776
Onchocerca volvulus		0.0037	0.0918	0.1226
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.0122	0.4845	0.4845
Toxoplasma gondii	exonuclease III APE	0.0019	0.0113	0.0519
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.1765	0.2049
Leishmania major	4-coumarate:coa ligase-like protein	0.0025	0.0374	0.1713
Mycobacterium leprae	PROBABLE NADH DEHYDROGENASE NDH	0.011	0.4282	0.874
Plasmodium falciparum	acyl-CoA synthetase	0.0019	0.0085	0.0591
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.0063	0.2133	0.2476
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0085	0.0051
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0037	0.0918	0.1803
Echinococcus multilocularis	fetal alzheimer antigen, falz	0.0024	0.0328	0.0381
Giardia lamblia	Endonuclease/Exonuclease/phosphatase	0.0019	0.0113	1
Trypanosoma brucei	hypothetical protein, conserved	0.0037	0.0918	0.6349
Mycobacterium tuberculosis	NADPH-dependent mycothiol reductase Mtr	0.0048	0.1446	0.1446
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0018	0.0039	0.0039
Onchocerca volvulus		0.0037	0.0918	0.1226
Mycobacterium tuberculosis	Probable NADH dehydrogenase Ndh	0.011	0.4282	0.4282
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0037	0.0918	0.1066
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.0038	0.0978	0.1136
Leishmania major	aldehyde dehydrogenase, mitochondrial precursor	0.0064	0.2182	1
Brugia malayi	hypothetical protein	0.0122	0.4815	1
Mycobacterium ulcerans	esterase/lipase LipP	0.0037	0.0918	0.4208
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.1765	0.2049
Leishmania major	4-coumarate:coa ligase-like protein	0.0025	0.0374	0.1713
Echinococcus granulosus	thioredoxin glutathione reductase	0.0048	0.1446	0.1679
Mycobacterium tuberculosis	Probable aldehyde dehydrogenase	0.0064	0.2182	0.2182
Echinococcus granulosus	aldehyde dehydrogenase mitochondrial	0.0064	0.2182	0.2533
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0085	0.0051
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0025	0.0374	0.1713
Trypanosoma cruzi	hypothetical protein, conserved	0.0037	0.0918	0.6349
Schistosoma mansoni	ap endonuclease	0.0019	0.0113	0.0132
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0037	0.0918	0.0918
Loa Loa (eye worm)	PHD-finger family protein	0.0022	0.0235	0.0366
Mycobacterium tuberculosis	Probable oxidoreductase	0.0122	0.4845	0.4845
Mycobacterium tuberculosis	Probable hydrolase	0.0037	0.0918	0.0918
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0018	0.0061	0.0071
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.1765	0.2049
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.1765	0.2049
Mycobacterium ulcerans	acyl-CoA synthetase	0.0025	0.0374	0.1713
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	0.0019	0.0113	0.0784
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0025	0.0374	0.0374
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0037	0.0918	0.1066
Echinococcus granulosus	fetal alzheimer antigen falz	0.0024	0.0328	0.0381
Mycobacterium tuberculosis	Probable lipase LipD	0.0037	0.0918	0.0918
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.1765	0.2049
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0037	0.0918	0.0918
Mycobacterium ulcerans	acyl-CoA synthetase	0.0025	0.0374	0.1713
Toxoplasma gondii	thioredoxin reductase	0.0048	0.1446	0.6627
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0025	0.0374	0.0374
Trichomonas vaginalis	esterase, putative	0.0037	0.0918	1
Loa Loa (eye worm)	thioredoxin reductase	0.0048	0.1446	0.2913
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.0122	0.4845	0.4845
Trichomonas vaginalis	ap endonuclease, putative	0.0019	0.0113	0.1234
Brugia malayi	PHD-finger family protein	0.0026	0.0443	0.092
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0019	0.0085	0.0392
Onchocerca volvulus	Huntingtin homolog	0.0122	0.4815	1
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0064	0.2182	1
Plasmodium vivax	hypothetical protein, conserved	0.0037	0.0918	0.6349
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	0.0019	0.0113	0.0784
Echinococcus granulosus	methyl CpG binding domain protein 2	0.0018	0.0061	0.0071
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1305	0.2615
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.0063	0.2133	0.2476
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0085	0.0051
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0918	0.1803
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0025	0.0374	1
Plasmodium falciparum	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0019	0.0113	0.0784
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0018	0.0039	0.0039
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0918	0.1803
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0374	0.0657
Trichomonas vaginalis	D-aminoacylase, putative	0.0037	0.0918	1
Mycobacterium tuberculosis	Conserved protein	0.0037	0.0918	0.0918
Mycobacterium tuberculosis	Probable membrane NADH dehydrogenase NdhA	0.011	0.4282	0.4282
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0018	0.0039	0.0039
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0085	0.0051
Leishmania major	trypanothione reductase	0.0048	0.1446	0.6627
Trichomonas vaginalis	D-aminoacylase, putative	0.0037	0.0918	1
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0374	0.0657
Plasmodium vivax	acyl-CoA synthetase, putative	0.0019	0.0085	0.0591
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0918	0.1803
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0018	0.0061	0.0071
Mycobacterium tuberculosis	Probable dehydrogenase	0.011	0.4282	0.4282
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0122	0.4845	1
Plasmodium vivax	glutathione reductase, putative	0.0048	0.1446	1
Mycobacterium ulcerans	lipase LipD	0.0037	0.0918	0.4208
Mycobacterium ulcerans	exodeoxyribonuclease III protein XthA	0.0019	0.0113	0.0519
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0374	0.0657
Echinococcus multilocularis	aldehyde dehydrogenase, mitochondrial	0.0064	0.2182	0.2533
Mycobacterium ulcerans	beta-lactamase	0.0037	0.0918	0.4208
Echinococcus granulosus	beta LACTamase domain containing family member	0.0037	0.0918	0.1066
Mycobacterium tuberculosis	Probable esterase LipL	0.0037	0.0918	0.0918
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0064	0.2182	1
Toxoplasma gondii	aldehyde dehydrogenase	0.0064	0.2182	1
Loa Loa (eye worm)	hypothetical protein	0.0122	0.4815	1
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0037	0.0918	0.0918
Echinococcus multilocularis	methyl CpG binding domain protein 2	0.0018	0.0061	0.0071
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0055	0.1765	0.3585
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0019	0.0113	0.0784
Trichomonas vaginalis	ap endonuclease, putative	0.0019	0.0113	0.1234
Plasmodium falciparum	thioredoxin reductase	0.0048	0.1446	1
Wolbachia endosymbiont of Brugia malayi	exonuclease III	0.0019	0.0113	1
Chlamydia trachomatis	acylglycerophosphoethanolamine acyltransferase	0.0019	0.0085	1
Echinococcus granulosus	histone lysine methyltransferase setb	0.0018	0.0061	0.0071
Brugia malayi	beta-lactamase family protein	0.0037	0.0918	0.1907
Mycobacterium leprae	Probable lipase LipE	0.0037	0.0918	0.1218
Echinococcus multilocularis	zinc finger protein	0.0021	0.0184	0.0214
Brugia malayi	AMP-binding enzyme family protein	0.0025	0.0374	0.0776
Brugia malayi	Bromodomain containing protein	0.0079	0.2876	0.5973
Treponema pallidum	exodeoxyribonuclease (exoA)	0.0019	0.0113	1
Loa Loa (eye worm)	hypothetical protein	0.0075	0.2668	0.5484
Mycobacterium tuberculosis	Conserved protein	0.0037	0.0918	0.0918
Schistosoma mansoni	zinc finger protein	0.0021	0.0184	0.0214
Brugia malayi	beta-lactamase family protein	0.0037	0.0918	0.1907
Mycobacterium tuberculosis	Probable lipase LipE	0.0037	0.0918	0.0918
Loa Loa (eye worm)	hypothetical protein	0.0043	0.1212	0.242
Echinococcus granulosus	geminin	0.0205	0.8615	1
Mycobacterium tuberculosis	Conserved protein	0.0037	0.0918	0.0918
Trypanosoma cruzi	trypanothione reductase, putative	0.0048	0.1446	1
Mycobacterium ulcerans	hypothetical protein	0.0025	0.0374	0.1713
Echinococcus multilocularis	geminin	0.0205	0.8615	1
Schistosoma mansoni	acetyl-CoA C-acetyltransferase	0.0024	0.0328	0.0381
Leishmania major	4-coumarate:coa ligase-like protein	0.0025	0.0374	0.1713
Leishmania major	apurinic/apyrimidinic endonuclease-redox protein	0.0019	0.0113	0.0519
Schistosoma mansoni	hypothetical protein	0.0205	0.8615	1
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0025	0.0374	0.1713
Onchocerca volvulus		0.0037	0.0918	0.1226
Mycobacterium tuberculosis	Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB	0.011	0.4282	0.4282
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0918	0.1803
Echinococcus granulosus	zinc finger protein	0.0021	0.0184	0.0214
Plasmodium falciparum	glutathione reductase	0.0048	0.1446	1
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0025	0.0374	1
Trichomonas vaginalis	penicillin-binding protein, putative	0.0037	0.0918	1
Loa Loa (eye worm)	hypothetical protein	0.0041	0.1097	0.2178
Mycobacterium tuberculosis	Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI)	0.0019	0.0113	0.0113
Entamoeba histolytica	acyl-coA synthetase, putative	0.0025	0.0374	1
Loa Loa (eye worm)	hypothetical protein	0.0122	0.4815	1
Mycobacterium tuberculosis	Putative ferredoxin reductase	0.011	0.4282	0.4282
Mycobacterium ulcerans	hypothetical protein	0.0037	0.0918	0.4208
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.1765	0.2049

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	2.0596 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)	2.2387 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)	4.1475 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)	79.4328 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
Potency (functional)	141.2538 uM	PubChem BioAssay. qHTS of PTHR Inhibitors: Primary Screen. (Class of assay: confirmatory)	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

ChEMBL: CHEMBL1304294

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 1205834