TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 432.475 | Formula: C23H24N6O3
H donors: 4 H acceptors: 4 LogP: 2.77 Rotable bonds: 8
Rule of 5 violations (Lipinski): 1
SMILES: O=C(CCc1ccc(cc1)C(=O)c1ccccc1)OCC1CNc2c(N1)c(N)nc(n2)N
InChi: 1S/C23H24N6O3/c24-21-19-22(29-23(25)28-21)26-12-17(27-19)13-32-18(30)11-8-14-6-9-16(10-7-14)20(31)15-4-2-1-3-5-15/h1-7,9-10,17,27H,8,11-13H2,(H5,24,25,26,28,29)
InChiKey: WODFQUPEKIJREU-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

No synonyms found for this compound

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology

No druggable targets predicted by orthology data

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Trichomonas vaginalis	phosphofructokinase, putative	0.0106	0.1627	0.3823
Mycobacterium ulcerans	6-phosphofructokinase	0.0106	0.1627	1
Schistosoma mansoni	peroxidasin	0.0079	0.1173	0.2283
Echinococcus multilocularis	telomerase reverse transcriptase subunit	0.0038	0.0478	0.0882
Entamoeba histolytica	phosphofructokinase, putative	0.0106	0.1627	1
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0151	0.0157
Echinococcus granulosus	RUN	0.0019	0.0151	0.0189
Onchocerca volvulus		0.0079	0.1173	0.2839
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0202	0.3276	0.4157
Brugia malayi	6-phosphofructokinase	0.0106	0.1627	0.1627
Echinococcus multilocularis	lipoxygenase domain containing protein	0.0019	0.0151	0.0182
Onchocerca volvulus	Peroxidase homolog	0.0079	0.1173	0.2839
Schistosoma mansoni	bromodomain-containing nuclear protein 1 brd1	0.0028	0.0307	0.0598
Brugia malayi	C2-HC type zinc finger protein C.e-MyT1	0.0053	0.0725	0.0725
Loa Loa (eye worm)	hypothetical protein	0.0079	0.1173	0.1466
Schistosoma mansoni	sex comb on midleg homolog	0.0046	0.0615	0.1196
Entamoeba histolytica	hypothetical protein	0.0035	0.0421	0.0833
Onchocerca volvulus		0.0046	0.0615	0.1289
Echinococcus granulosus	lipoxygenase domain containing protein	0.0019	0.0151	0.0189
Echinococcus multilocularis	RNA directed DNA polymerase	0.0038	0.0478	0.0882
Brugia malayi	Animal haem peroxidase family protein	0.0079	0.1173	0.1173
Loa Loa (eye worm)	hypothetical protein	0.0079	0.1173	0.1466
Loa Loa (eye worm)	PHD-finger family protein	0.0028	0.0307	0.0358
Schistosoma mansoni	loxhd1	0.0019	0.0151	0.0293
Leishmania major	ATP-dependent phosphofructokinase	0.0106	0.1627	1
Plasmodium vivax	6-phosphofructokinase, putative	0.0029	0.0311	0.9521
Schistosoma mansoni	jumonji domain containing protein	0.0074	0.1082	0.2105
Loa Loa (eye worm)	mbt repeat family protein	0.0046	0.0615	0.0751
Schistosoma mansoni	atypical protein kinase C	0.0014	0.0066	0.0128
Echinococcus granulosus	dnaJ subfamily C 6	0.006	0.084	0.1724
Loa Loa (eye worm)	hypothetical protein	0.047	0.7843	1
Echinococcus multilocularis	endonuclease exonuclease phosphatase	0.0183	0.2942	0.6156
Echinococcus multilocularis	polycomb protein SCMH1	0.0046	0.0615	0.1175
Giardia lamblia	Pyrophosphate-fructose 6-phosphate 1-phosphotransferase alpha subunit	0.0029	0.0311	1
Schistosoma mansoni	lipoxygenase	0.0054	0.074	0.1439
Onchocerca volvulus		0.0076	0.1125	0.2705
Brugia malayi	hypothetical protein	0.0079	0.1173	0.1173
Onchocerca volvulus	Peroxidasin homolog	0.0079	0.1173	0.2839
Onchocerca volvulus	Dual oxidase homolog	0.0079	0.1173	0.2839
Schistosoma mansoni	lipoxygenase	0.0019	0.0151	0.0293
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0056	0.0775	0.4675
Schistosoma mansoni	scm-relatedprotein containing 4 mbt domains (sfmbt)	0.0046	0.0615	0.1196
Echinococcus granulosus	protein kinase C gamma type	0.0048	0.064	0.128
Brugia malayi	3-hydroxyacyl-CoA dehydrogenase type II	0.0056	0.0775	0.0775
Brugia malayi	hypothetical protein	0.0019	0.0151	0.0151
Echinococcus multilocularis	6 phosphofructokinase	0.0106	0.1627	0.3341
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0615	0.0751
Loa Loa (eye worm)	jmjC domain-containing protein	0.0059	0.0822	0.1017
Toxoplasma gondii	phosphofructokinase PFKII	0.0029	0.0311	0.3037
Echinococcus multilocularis	dnaJ subfamily C 6	0.006	0.084	0.1657
Plasmodium vivax	SET domain protein, putative	0.0029	0.0319	1
Toxoplasma gondii	phosphofructokinase domain-containing protein	0.0029	0.0311	0.3037
Brugia malayi	Animal haem peroxidase family protein	0.0079	0.1173	0.1173
Brugia malayi	Matrixin family protein	0.0076	0.1125	0.1125
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0028	0.0301	0.0523
Echinococcus multilocularis	conserved hypothetical protein	0.0288	0.4738	1
Schistosoma mansoni	hypothetical protein	0.0035	0.0421	0.0818
Trichomonas vaginalis	phosphofructokinase, putative	0.0106	0.1627	0.3823
Echinococcus multilocularis	arachidonate 5 lipoxygenase	0.0054	0.074	0.1442
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0319	0.0373
Onchocerca volvulus	Matrilysin homolog	0.0169	0.271	0.7105
Loa Loa (eye worm)	jmjC domain-containing protein	0.0034	0.0409	0.0488
Schistosoma mansoni	matrix metallopeptidase-7 (M10 family)	0.0076	0.1125	0.2189
Echinococcus multilocularis	PHD finger protein rhinoceros	0.0028	0.0307	0.0517
Echinococcus multilocularis	peroxidasin	0.0079	0.1173	0.2371
Loa Loa (eye worm)	hypothetical protein	0.0049	0.0653	0.08
Echinococcus multilocularis	peregrin	0.0028	0.0307	0.0517
Echinococcus granulosus	jumonji domain containing protein	0.0039	0.0497	0.096
Brugia malayi	protein kinase C II.	0.0015	0.0087	0.0087
Loa Loa (eye worm)	hypothetical protein	0.0079	0.1173	0.1466
Echinococcus multilocularis	lipoxygenase domain containing protein	0.0019	0.0151	0.0182
Brugia malayi	Matrixin family protein	0.0076	0.1125	0.1125
Loa Loa (eye worm)	animal heme peroxidase	0.0079	0.1173	0.1466
Loa Loa (eye worm)	hypothetical protein	0.0079	0.1173	0.1466
Brugia malayi	Matrix metalloprotease, N-terminal domain containing protein	0.0093	0.1409	0.1409
Mycobacterium leprae	PROBABLE 6-PHOSPHOFRUCTOKINASE PFKA (PHOSPHOHEXOKINASE) (PHOSPHOFRUCTOKINASE)	0.0106	0.1627	1
Schistosoma mansoni	hypothetical protein	0.0019	0.0151	0.0293
Schistosoma mansoni	glucose-6-phosphatase	0.029	0.477	0.9279
Loa Loa (eye worm)	matrixin family protein	0.0184	0.297	0.3765
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0151	0.0157
Echinococcus granulosus	histone lysine methyltransferase setb	0.0029	0.0319	0.0564
Loa Loa (eye worm)	hypothetical protein	0.0079	0.1173	0.1466
Brugia malayi	Matrixin family protein	0.0076	0.1125	0.1125
Entamoeba histolytica	phosphofructokinase, putative	0.0106	0.1627	1
Plasmodium falciparum	phd finger protein, putative	0.0028	0.0307	0.978
Loa Loa (eye worm)	6-phosphofructokinase	0.0106	0.1627	0.2046
Treponema pallidum	diphosphate--fructose-6-phosphate 1-phosphotransferase	0.0106	0.1627	1
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0056	0.0775	0.4675
Echinococcus multilocularis	3 hydroxyacyl coenzyme A dehydrogenase type 2	0.0056	0.0775	0.1519
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0029	0.0319	0.0542
Echinococcus multilocularis	conserved hypothetical protein	0.0288	0.4738	1
Brugia malayi	Matrixin family protein	0.0184	0.297	0.297
Loa Loa (eye worm)	hypothetical protein	0.0079	0.1173	0.1466
Loa Loa (eye worm)	AGC/PKC/ETA protein kinase	0.0015	0.0087	0.0075
Loa Loa (eye worm)	blistered cuticle protein 3	0.0079	0.1173	0.1466
Echinococcus multilocularis	matrix metallopeptidase 7 (M10 family)	0.0277	0.4555	0.9609
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0029	0.0319	0.062
Trypanosoma brucei	RNA helicase, putative	0.0312	0.5141	1
Schistosoma mansoni	serine/threonine protein kinase	0.0054	0.0741	0.1441
Leishmania major	3-oxoacyl-(acyl-carrier protein) reductase, putative	0.0056	0.0775	0.4675
Onchocerca volvulus		0.023	0.3753	1
Loa Loa (eye worm)	doublecortin family protein	0.0019	0.0151	0.0157
Echinococcus granulosus	lysine specific demethylase 5A	0.0034	0.0409	0.0765
Schistosoma mansoni	matrix metallopeptidase-9 (M10 family)	0.008	0.1197	0.2329
Schistosoma mansoni	rab6-interacting	0.0019	0.0151	0.0293
Mycobacterium tuberculosis	Probable 6-phosphofructokinase PfkA (phosphohexokinase) (phosphofructokinase)	0.0106	0.1627	1
Schistosoma mansoni	polycystin 1-related	0.0019	0.0151	0.0293
Entamoeba histolytica	hypothetical protein	0.0035	0.0421	0.0833
Brugia malayi	6-phosphofructokinase	0.0106	0.1627	0.1627
Schistosoma mansoni	rab6-interacting	0.0019	0.0151	0.0293
Schistosoma mansoni	hypothetical protein	0.0108	0.1669	0.3247
Loa Loa (eye worm)	hypothetical protein	0.0079	0.1173	0.1466
Entamoeba histolytica	phosphofructokinase, putative	0.0106	0.1627	1
Brugia malayi	jmjC domain containing protein	0.0034	0.0409	0.0409
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0035	0.0421	0.079
Entamoeba histolytica	hypothetical protein	0.0035	0.0421	0.0833
Onchocerca volvulus	Alhambra homolog	0.0028	0.0307	0.0435
Echinococcus granulosus	lipoxygenase domain containing protein	0.0019	0.0151	0.0189
Echinococcus granulosus	peroxidasin	0.0079	0.1173	0.2467
Onchocerca volvulus		0.0079	0.1173	0.2839
Echinococcus granulosus	Transcription factor JmjC domain containing protein	0.0093	0.1408	0.2989
Echinococcus granulosus	arachidonate 5 lipoxygenase	0.0054	0.074	0.1501
Loa Loa (eye worm)	animal heme peroxidase	0.0079	0.1173	0.1466
Schistosoma mansoni	6-phosphofructokinase	0.0106	0.1627	0.3165
Brugia malayi	Peroxidasin	0.0079	0.1173	0.1173
Mycobacterium ulcerans	hydrolase	0.0093	0.1409	0.8636
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0035	0.0421	0.0759
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0029	0.0319	0.062
Loa Loa (eye worm)	6-phosphofructokinase	0.0106	0.1627	0.2046
Plasmodium vivax	hypothetical protein, conserved	0.0028	0.0307	0.9312
Loa Loa (eye worm)	hypothetical protein	0.0076	0.1125	0.1404
Brugia malayi	Matrixin family protein	0.0076	0.1125	0.1125
Brugia malayi	Pre-SET motif family protein	0.0029	0.0319	0.0319
Toxoplasma gondii	6-phosphofructokinase	0.0029	0.0311	0.3037
Brugia malayi	Animal haem peroxidase family protein	0.0079	0.1173	0.1173
Echinococcus multilocularis	protein kinase c epsilon type	0.0015	0.0087	0.0045
Loa Loa (eye worm)	hypothetical protein	0.0076	0.1125	0.1404
Brugia malayi	Bromodomain containing protein	0.0028	0.0307	0.0307
Schistosoma mansoni	myelin transcription factor 1 myt1	0.0053	0.0725	0.1409
Trypanosoma brucei	ATP-dependent 6-phosphofructokinase, glycosomal	0.0106	0.1627	0.3128
Loa Loa (eye worm)	hypothetical protein	0.0079	0.1173	0.1466
Brugia malayi	Doublecortin family protein	0.0019	0.0151	0.0151
Brugia malayi	jmjC domain containing protein	0.0093	0.1408	0.1408
Brugia malayi	Animal haem peroxidase family protein	0.0079	0.1173	0.1173
Schistosoma mansoni	serine/threonine protein kinase	0.0054	0.0741	0.1441
Trichomonas vaginalis	phosphofructokinase, putative	0.0106	0.1627	0.3823
Echinococcus multilocularis	serine threonine protein kinase	0.0048	0.064	0.123
Plasmodium falciparum	ATP-dependent 6-phosphofructokinase	0.0029	0.0311	1
Echinococcus granulosus	3 hydroxyacyl coenzyme A dehydrogenase type 2	0.0056	0.0775	0.158
Loa Loa (eye worm)	3-hydroxyacyl-CoA dehydrogenase type II	0.0052	0.0711	0.0875
Loa Loa (eye worm)	phosphofructokinase	0.0106	0.1627	0.2046
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0307	0.0358
Echinococcus granulosus	PHD finger protein rhinoceros	0.0028	0.0307	0.0538
Loa Loa (eye worm)	MBCTL1	0.0053	0.0725	0.0892
Echinococcus multilocularis	Protein kinase C, brain isozyme	0.0054	0.0741	0.1445
Loa Loa (eye worm)	DnaJ domain-containing protein	0.006	0.084	0.1039
Brugia malayi	Cytochrome P450 family protein	0.0012	0.0028	0.0028
Echinococcus multilocularis	Polycystic kidney disease protein	0.0019	0.0151	0.0182
Loa Loa (eye worm)	animal heme peroxidase	0.0079	0.1173	0.1466
Onchocerca volvulus	Matrix metalloproteinase homolog	0.0169	0.271	0.7105
Loa Loa (eye worm)	hypothetical protein	0.0079	0.1173	0.1466
Onchocerca volvulus		0.0079	0.1173	0.2839
Echinococcus granulosus	6 phosphofructokinase	0.0106	0.1627	0.3477
Onchocerca volvulus		0.0108	0.1669	0.4214
Entamoeba histolytica	hypothetical protein	0.0035	0.0421	0.0833
Echinococcus granulosus	SAM and MBT domain containing protein	0.0046	0.0615	0.1223
Loa Loa (eye worm)	animal heme peroxidase	0.0079	0.1173	0.1466
Brugia malayi	Pre-SET motif family protein	0.0202	0.3276	0.3276
Schistosoma mansoni	transcription factor LCR-F1	0.0035	0.0421	0.0818
Onchocerca volvulus	Matrilysin homolog	0.0076	0.1125	0.2705
Trypanosoma cruzi	ATP-dependent 6-phosphofructokinase, glycosomal	0.0106	0.1627	1
Loa Loa (eye worm)	hypothetical protein	0.0126	0.1975	0.2491
Brugia malayi	mbt repeat family protein	0.0046	0.0615	0.0615
Echinococcus granulosus	Protein kinase C brain isozyme	0.0054	0.0741	0.1503
Echinococcus multilocularis	Transcription factor, JmjC domain containing protein	0.0093	0.1408	0.2872
Brugia malayi	hypothetical protein	0.0035	0.0421	0.0421
Echinococcus granulosus	RNA directed DNA polymerase	0.0038	0.0478	0.0918
Brugia malayi	PHD-finger family protein	0.0028	0.0307	0.0307
Echinococcus granulosus	matrix metallopeptidase 7 M10 family	0.0277	0.4555	1
Echinococcus multilocularis	histone acetyltransferase MYST2	0.0053	0.0725	0.141
Echinococcus granulosus	Polycystic kidney disease protein	0.0019	0.0151	0.0189
Onchocerca volvulus	Polycomb protein Sfmbt homolog	0.0046	0.0615	0.1289
Brugia malayi	Animal haem peroxidase family protein	0.0079	0.1173	0.1173
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0034	0.0409	0.0796
Schistosoma mansoni	sex comb on midleg homolog	0.0046	0.0615	0.1196
Echinococcus granulosus	protein kinase c epsilon type	0.0015	0.0087	0.0046
Plasmodium vivax	6-phosphofructokinase, putative	0.0029	0.0311	0.9521
Echinococcus multilocularis	RUN	0.0019	0.0151	0.0182
Echinococcus multilocularis	jumonji domain containing protein	0.0039	0.0497	0.0922
Onchocerca volvulus		0.0029	0.0319	0.0467
Echinococcus granulosus	polycomb protein SCMH1	0.0046	0.0615	0.1223
Brugia malayi	Hemopexin family protein	0.0108	0.1669	0.1669
Trichomonas vaginalis	set domain proteins, putative	0.023	0.3753	1
Loa Loa (eye worm)	hypothetical protein	0.0079	0.1173	0.1466
Brugia malayi	Blistered cuticle protein 3	0.0079	0.1173	0.1173
Schistosoma mansoni	serine/threonine protein kinase	0.0015	0.0087	0.0169
Brugia malayi	mbt repeat family protein	0.0046	0.0615	0.0615
Trichomonas vaginalis	phosphofructokinase, putative	0.0106	0.1627	0.3823
Loa Loa (eye worm)	hypothetical protein	0.0252	0.4132	0.5252
Brugia malayi	Protein kinase c protein 2	0.0046	0.0602	0.0602
Mycobacterium tuberculosis	Probable peptidoglycan hydrolase	0.0093	0.1409	0.7439
Loa Loa (eye worm)	hypothetical protein	0.0079	0.1173	0.1466
Schistosoma mansoni	hypothetical protein	0.006	0.084	0.1634
Echinococcus multilocularis	suppression of tumorigenicity 18 protein	0.0053	0.0725	0.141
Loa Loa (eye worm)	hypothetical protein	0.0044	0.0578	0.0704
Echinococcus multilocularis	SAM and MBT domain containing protein	0.0046	0.0615	0.1175
Loa Loa (eye worm)	hypothetical protein	0.0053	0.0725	0.0892
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0029	0.0319	1
Schistosoma mansoni	hypothetical protein	0.0282	0.4634	0.9014
Echinococcus granulosus	suppression of tumorigenicity 18 protein	0.0053	0.0725	0.1467
Brugia malayi	Cytochrome P450 family protein	0.0012	0.0028	0.0028
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0478	0.0576
Loa Loa (eye worm)	matrix metalloproteinase	0.0076	0.1125	0.1404
Loa Loa (eye worm)	matrixin family protein	0.0169	0.271	0.3432
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0034	0.0409	0.0796
Schistosoma mansoni	peroxidasin	0.0079	0.1173	0.2283
Echinococcus granulosus	endonuclease exonuclease phosphatase	0.0183	0.2942	0.6406
Loa Loa (eye worm)	hypothetical protein	0.0079	0.1173	0.1466
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0029	0.0319	0.062
Brugia malayi	hypothetical protein	0.0019	0.0151	0.0151
Loa Loa (eye worm)	AGC/PKC/ALPHA protein kinase	0.004	0.0502	0.0607
Brugia malayi	phosphofructokinase	0.0106	0.1627	0.1627
Brugia malayi	DnaJ domain containing protein	0.006	0.084	0.084
Loa Loa (eye worm)	hypothetical protein	0.0093	0.1409	0.1767
Schistosoma mansoni	hypothetical protein	0.0028	0.0307	0.0598
Onchocerca volvulus	Peroxidase homolog	0.0079	0.1173	0.2839
Echinococcus granulosus	peregrin	0.0028	0.0307	0.0538
Loa Loa (eye worm)	hypothetical protein	0.0079	0.1173	0.1466
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0029	0.0319	0.0542
Schistosoma mansoni	hypothetical protein	0.0312	0.5141	1
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0029	0.0319	0.062
Onchocerca volvulus	Peroxidasin homolog	0.0079	0.1173	0.2839
Trichomonas vaginalis	protein kinase inhibitor, putative	0.006	0.084	0.1537
Loa Loa (eye worm)	hypothetical protein	0.0076	0.1125	0.1404
Loa Loa (eye worm)	hypothetical protein	0.0079	0.1173	0.1466
Chlamydia trachomatis	fructose-6-phosphate phosphotransferase	0.0029	0.0311	0.5
Plasmodium falciparum	ATP-dependent 6-phosphofructokinase	0.0029	0.0311	1
Echinococcus multilocularis	lysine specific demethylase 5A	0.0034	0.0409	0.0735
Chlamydia trachomatis	fructose-6-phosphate phosphotransferase	0.0029	0.0311	0.5
Echinococcus granulosus	histone acetyltransferase MYST2	0.0053	0.0725	0.1467
Schistosoma mansoni	alzheimer's disease beta-amyloid related	0.0217	0.3534	0.6875
Schistosoma mansoni	6-phosphofructokinase	0.0106	0.1627	0.3165
Schistosoma mansoni	3-hydroxyacyl-CoA dehydrogenase	0.0056	0.0775	0.1508
Onchocerca volvulus	Chorion peroxidase homolog	0.0079	0.1173	0.2839

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 48 uM	Inhibitory activity against human neuronal nitric oxide synthase (NOS-I)	ChEMBL.	12086480
IC50 (binding)	= 48 uM	Inhibitory activity against human neuronal nitric oxide synthase (NOS-I)	ChEMBL.	12086480

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

No external resources registered for this compound

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 164231