TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 311.401 | Formula: C17H17N3OS
H donors: 3 H acceptors: 2 LogP: 1.9 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: OCCNCc1cccc2c1Cc1c2n[nH]c1c1ccsc1
InChi: 1S/C17H17N3OS/c21-6-5-18-9-11-2-1-3-13-14(11)8-15-16(19-20-17(13)15)12-4-7-22-10-12/h1-4,7,10,18,21H,5-6,8-9H2,(H,19,20)
InChiKey: XKMZLNMFPLJPKF-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

Species	Target name	Source	Bibliographic reference
Homo sapiens	v-kit Hardy-Zuckerman 4 feline sarcoma viral oncogene homolog	Starlite/ChEMBL	References
Homo sapiens	fms-related tyrosine kinase 1	Starlite/ChEMBL	References
Homo sapiens	kinase insert domain receptor	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Brugia malayi	Immunoglobulin I-set domain containing protein	Get druggable targets OG5_130320	All targets in OG5_130320
Echinococcus granulosus	macrophage colony stimulating factor 1 receptor	Get druggable targets OG5_132967	All targets in OG5_132967
Onchocerca volvulus	Tyrosine kinase homolog	Get druggable targets OG5_130320	All targets in OG5_130320
Onchocerca volvulus		Get druggable targets OG5_130320	All targets in OG5_130320
Loa Loa (eye worm)	TK/KIN16 protein kinase	Get druggable targets OG5_130320	All targets in OG5_130320

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
Onchocerca volvulus		0.0375	0.2823	0.7778
Trichomonas vaginalis	glucosylceramidase, putative	0.0276	0.204	1
Echinococcus granulosus	caspase 2	0.0093	0.0599	0.1092
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0038	0.0165	0.0606
Echinococcus multilocularis	apoptotic protease activating factor 1	0.0045	0.0218	0.0662
Schistosoma mansoni	subfamily C14A unassigned peptidase (C14 family)	0.0048	0.0244	0.0898
Trichomonas vaginalis	glucosylceramidase, putative	0.0276	0.204	1
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0105	0.018
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0165	0.0349
Trichomonas vaginalis	glucosylceramidase, putative	0.0191	0.1368	0.664
Trichomonas vaginalis	Clan CD, family C14, metacaspase-like cysteine peptidase	0.0048	0.0244	0.1015
Plasmodium vivax	hypothetical protein, conserved	0.0038	0.0165	0.6107
Brugia malayi	hypothetical protein	0.0473	0.3597	1
Brugia malayi	Pre-SET motif family protein	0.0032	0.0114	0.0318
Loa Loa (eye worm)	hypothetical protein	0.0093	0.0599	0.1568
Trypanosoma cruzi	hypothetical protein, conserved	0.0038	0.0165	0.6107
Echinococcus granulosus	geminin	0.0361	0.2712	0.5232
Echinococcus multilocularis	histone acetyltransferase MYST2	0.0058	0.0321	0.1048
Schistosoma mansoni	scm-relatedprotein containing 4 mbt domains (sfmbt)	0.0051	0.0265	0.0976
Schistosoma mansoni	hypothetical protein	0.0052	0.0269	0.0992
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0218	0.0497
Toxoplasma gondii	ICE family protease (caspase) p20 domain-containing protein	0.0048	0.0244	0.1295
Echinococcus granulosus	caspase 3	0.0079	0.0489	0.0878
Schistosoma mansoni	alpha-galactosidase/alpha-n-acetylgalactosaminidase	0.0031	0.011	0.0404
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0032	0.0114	0.0421
Echinococcus granulosus	polycomb protein SCMH1	0.0051	0.0265	0.0439
Trypanosoma cruzi	metacaspase, putative	0.0048	0.0244	1
Loa Loa (eye worm)	hypothetical protein	0.0253	0.1856	0.5106
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0222	0.1617	0.4433
Trypanosoma brucei	metacaspase MCA3	0.0048	0.0244	1
Trichomonas vaginalis	conserved hypothetical protein	0.0048	0.0244	0.1015
Echinococcus granulosus	survival motor neuron protein 1	0.0253	0.1856	0.3556
Loa Loa (eye worm)	hypothetical protein	0.0059	0.0326	0.0803
Echinococcus multilocularis	Protein lozenge	0.0059	0.0331	0.1087
Loa Loa (eye worm)	hypothetical protein	0.0147	0.1027	0.2773
Plasmodium falciparum	metacaspase-like protein	0.0048	0.0244	1
Schistosoma mansoni	defective proboscis extension response (dpr)-related	0.0044	0.021	0.0774
Onchocerca volvulus		0.0045	0.0218	0.0296
Loa Loa (eye worm)	hypothetical protein	0.0044	0.021	0.0477
Onchocerca volvulus		0.0038	0.0165	0.0144
Brugia malayi	mucosa associated lymphoid tissue lymphoma translocation protein 1	0.0048	0.0244	0.0678
Echinococcus granulosus	macrophage colony stimulating factor 1 receptor	0.0669	0.5147	1
Echinococcus granulosus	Immunoglobulin	0.0044	0.021	0.0332
Loa Loa (eye worm)	hypothetical protein	0.0044	0.021	0.0477
Schistosoma mansoni	vesicular amine transporter	0.0044	0.021	0.0774
Echinococcus multilocularis	caspase	0.0128	0.087	0.3104
Loa Loa (eye worm)	hypothetical protein	0.0058	0.0321	0.0787
Trichomonas vaginalis	glucosylceramidase, putative	0.0276	0.204	1
Onchocerca volvulus		0.0038	0.0165	0.0144
Giardia lamblia	GTP-binding nuclear protein RAN/TC4	0.0023	0.0041	0.5
Echinococcus multilocularis	basement membrane specific heparan sulfate	0.0044	0.021	0.0634
Echinococcus granulosus	histone lysine methyltransferase setb	0.0032	0.0114	0.0144
Brugia malayi	Fibronectin type III domain containing protein	0.0044	0.021	0.0584
Echinococcus multilocularis	survival motor neuron protein 1	0.0253	0.1856	0.6796
Onchocerca volvulus	Polycomb protein Sfmbt homolog	0.0051	0.0265	0.0432
Loa Loa (eye worm)	hypothetical protein	0.0044	0.021	0.0477
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0025	0.0059	0.0091
Schistosoma mansoni	sex comb on midleg homolog	0.0051	0.0265	0.0976
Echinococcus multilocularis	caspase 2	0.0093	0.0599	0.2088
Trichomonas vaginalis	alpha-galactosidase/alpha-N-acetylgalactosaminidase, putative	0.0147	0.1027	0.4932
Trypanosoma brucei	Metacaspase-4	0.0048	0.0244	1
Schistosoma mansoni	hypothetical protein	0.031	0.2307	0.8507
Leishmania major	hypothetical protein, conserved	0.0038	0.0165	0.6107
Trichomonas vaginalis	Clan CD, family C14, metacaspase-like cysteine peptidase	0.0048	0.0244	0.1015
Onchocerca volvulus		0.0253	0.186	0.5012
Loa Loa (eye worm)	mbt repeat family protein	0.0051	0.0265	0.063
Echinococcus multilocularis	neuroglian	0.005	0.0261	0.0825
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0032	0.0114	0.0421
Plasmodium falciparum	ataxin-2 like protein, putative	0.0027	0.0075	0.1702
Trypanosoma brucei	PAB1-binding protein , putative	0.0027	0.0075	0.1702
Trypanosoma cruzi	metacaspase 5, putative	0.0048	0.0244	1
Trypanosoma brucei	metacaspase 5, putative	0.0048	0.0244	1
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0038	0.0165	0.0606
Echinococcus granulosus	SAM and MBT domain containing protein	0.0051	0.0265	0.0439
Toxoplasma gondii	LsmAD domain-containing protein	0.0027	0.0075	0.022
Loa Loa (eye worm)	nucleolar RNA-associated protein alpha	0.0327	0.2444	0.6758
Echinococcus granulosus	twitchin	0.005	0.0261	0.0432
Trichomonas vaginalis	importin beta-1, putative	0.0025	0.0059	0.0091
Trichomonas vaginalis	D-aminoacylase, putative	0.0038	0.0165	0.062
Mycobacterium ulcerans	3-dehydroquinate dehydratase	0.1284	1	1
Brugia malayi	hypothetical protein	0.0027	0.0075	0.0209
Loa Loa (eye worm)	hypothetical protein	0.0473	0.3597	1
Trichomonas vaginalis	glucosylceramidase, putative	0.0276	0.204	1
Trichomonas vaginalis	glucosylceramidase, putative	0.0181	0.1291	0.6255
Brugia malayi	hypothetical protein	0.0045	0.0218	0.0605
Trichomonas vaginalis	conserved hypothetical protein	0.0048	0.0244	0.1015
Brugia malayi	N-terminal motif family protein	0.0193	0.1385	0.385
Trichomonas vaginalis	D-aminoacylase, putative	0.0038	0.0165	0.062
Loa Loa (eye worm)	hypothetical protein	0.0048	0.0244	0.0571
Schistosoma mansoni	cell adhesion molecule	0.0052	0.0275	0.1014
Schistosoma mansoni	hypothetical protein	0.0361	0.2712	1
Echinococcus multilocularis	Immunoglobulin	0.0044	0.021	0.0634
Trypanosoma cruzi	PAB1-binding protein , putative	0.0027	0.0075	0.1702
Trichomonas vaginalis	conserved hypothetical protein	0.0048	0.0244	0.1015
Echinococcus multilocularis	suppression of tumorigenicity 18 protein	0.0058	0.0321	0.1048
Echinococcus granulosus	defective proboscis extension response	0.0044	0.021	0.0332
Trichomonas vaginalis	esterase, putative	0.0038	0.0165	0.062
Trichomonas vaginalis	glucosylceramidase, putative	0.0276	0.204	1
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0044	0.021	0.0584
Brugia malayi	beta-lactamase family protein	0.0038	0.0165	0.0458
Echinococcus multilocularis	endonuclease exonuclease phosphatase	0.0201	0.1447	0.5266
Schistosoma mansoni	nephrin	0.005	0.0261	0.0962
Trichomonas vaginalis	glucosylceramidase, putative	0.0191	0.1368	0.664
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0114	0.0207
Toxoplasma gondii	ICE family protease (caspase) p20 domain-containing protein	0.0048	0.0244	0.1295
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0075	0.0097
Schistosoma mansoni	lozenge	0.0059	0.0331	0.122
Loa Loa (eye worm)	TK/KIN16 protein kinase	0.043	0.3257	0.9044
Onchocerca volvulus	Cell death protein 3 homolog	0.0093	0.0599	0.139
Onchocerca volvulus		0.0038	0.0165	0.0144
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0165	0.0349
Trichomonas vaginalis	glucosylceramidase, putative	0.0181	0.1291	0.6255
Schistosoma mansoni	alpha-galactosidase/alpha-n-acetylgalactosaminidase	0.0147	0.1027	0.3785
Schistosoma mansoni	alpha-galactosidase/alpha-n-acetylgalactosaminidase	0.0221	0.1608	0.5929
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.0052	0.0269	0.0749
Echinococcus granulosus	roundabout 2	0.0059	0.0326	0.0559
Loa Loa (eye worm)	MBCTL1	0.0058	0.0321	0.0787
Echinococcus multilocularis	importin subunit beta 1	0.0031	0.0105	0.0239
Loa Loa (eye worm)	hypothetical protein	0.0473	0.3597	1
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0032	0.0114	0.0276
Onchocerca volvulus	Rap guanine nucleotide exchange factor 1 homolog	0.0193	0.1385	0.3648
Brugia malayi	hypothetical protein	0.0253	0.1856	0.5161
Trichomonas vaginalis	Clan CD, family C14, metacaspase-like cysteine peptidase	0.0048	0.0244	0.1015
Brugia malayi	Cell death protein 3 precursor	0.0093	0.0599	0.1664
Trichomonas vaginalis	Clan CD, family C14, metacaspase-like cysteine peptidase	0.0048	0.0244	0.1015
Schistosoma mansoni	Neurotrimin precursor (hNT)	0.0044	0.021	0.0774
Loa Loa (eye worm)	hypothetical protein	0.0044	0.021	0.0477
Brugia malayi	Melibiase family protein	0.0147	0.1027	0.2855
Schistosoma mansoni	ran	0.0023	0.0041	0.0149
Schistosoma mansoni	hypothetical protein	0.0045	0.0218	0.0801
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0032	0.0114	0.0421
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0244	0.1792	0.1654
Echinococcus granulosus	histone acetyltransferase MYST2	0.0058	0.0321	0.0548
Trypanosoma cruzi	importin beta-1 subunit, putative	0.0025	0.0059	0.0892
Schistosoma mansoni	alpha-galactosidase/alpha-n-acetylgalactosaminidase	0.0221	0.1608	0.5929
Trypanosoma cruzi	metacaspase, putative	0.0048	0.0244	1
Entamoeba histolytica	hypothetical protein	0.0025	0.0059	1
Trichomonas vaginalis	penicillin-binding protein, putative	0.0038	0.0165	0.062
Echinococcus granulosus	neurotracting:lsamp:neurotrimin:obcam	0.0052	0.0275	0.0459
Echinococcus multilocularis	roundabout 2	0.0059	0.0326	0.1069
Toxoplasma gondii	ICE family protease (caspase) p20 domain-containing protein	0.0048	0.0244	0.1295
Brugia malayi	mbt repeat family protein	0.0051	0.0265	0.0737
Plasmodium vivax	importin-beta 2, putative	0.0031	0.0105	0.3145
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0165	0.0349
Brugia malayi	O-Glycosyl hydrolase family 30 protein	0.0276	0.204	0.5672
Trichomonas vaginalis	glucosylceramidase, putative	0.0181	0.1291	0.6255
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0032	0.0114	0.0421
Leishmania major	importin beta-1 subunit, putative	0.0025	0.0059	0.0892
Loa Loa (eye worm)	runx1	0.0059	0.0331	0.0817
Plasmodium vivax	metacaspase 1, putative	0.0048	0.0244	1
Loa Loa (eye worm)	hypothetical protein	0.0044	0.021	0.0477
Brugia malayi	GTP-binding nuclear protein RAN/TC4	0.0023	0.0041	0.0113
Trichomonas vaginalis	set domain proteins, putative	0.0253	0.186	0.9098
Echinococcus granulosus	beta LACTamase domain containing family member	0.0038	0.0165	0.0243
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0038	0.0165	0.0349
Plasmodium vivax	SET domain protein, putative	0.0032	0.0114	0.3632
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0165	0.0349
Echinococcus granulosus	apoptotic protease activating factor 1	0.0045	0.0218	0.0346
Schistosoma mansoni	hypothetical protein	0.0361	0.2712	1
Trypanosoma cruzi	hypothetical protein, conserved	0.0038	0.0165	0.6107
Toxoplasma gondii	melibiase subfamily protein	0.0221	0.1608	1
Onchocerca volvulus		0.0473	0.3597	1
Echinococcus multilocularis	snurportin 1	0.0327	0.2444	0.8996
Trichomonas vaginalis	conserved hypothetical protein	0.0048	0.0244	0.1015
Plasmodium falciparum	metacaspase 1	0.0048	0.0244	1
Trichomonas vaginalis	glucosylceramidase, putative	0.0181	0.1291	0.6255
Loa Loa (eye worm)	hypothetical protein	0.0044	0.021	0.0477
Echinococcus granulosus	snurportin 1	0.0327	0.2444	0.4706
Echinococcus multilocularis	Alpha N acetylgalactosaminidase	0.0221	0.1608	0.5868
Echinococcus multilocularis	caspase 3, apoptosis cysteine peptidase	0.0128	0.087	0.3104
Leishmania major	hypothetical protein, conserved	0.0027	0.0075	0.1702
Echinococcus granulosus	caspase 8	0.0048	0.0244	0.0398
Trichomonas vaginalis	glucosylceramidase, putative	0.0181	0.1291	0.6255
Brugia malayi	mbt repeat family protein	0.0051	0.0265	0.0737
Brugia malayi	Importin beta-1 subunit	0.0031	0.0105	0.0291
Onchocerca volvulus		0.0052	0.0269	0.0445
Echinococcus granulosus	suppression of tumorigenicity 18 protein	0.0058	0.0321	0.0548
Echinococcus granulosus	caspase 3 apoptosis cysteine peptidase	0.0128	0.087	0.1624
Trichomonas vaginalis	Clan CD, family C14, metacaspase-like cysteine peptidase	0.0048	0.0244	0.1015
Echinococcus multilocularis	polycomb protein SCMH1	0.0051	0.0265	0.0839
Toxoplasma gondii	ABC1 family protein	0.0038	0.0165	0.0791
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0031	0.0105	0.0126
Schistosoma mansoni	alpha-galactosidase/alpha-n-acetylgalactosaminidase	0.0147	0.1027	0.3785
Brugia malayi	beta-lactamase	0.0038	0.0165	0.0458
Trypanosoma cruzi	PAB1-binding protein , putative	0.0027	0.0075	0.1702
Trypanosoma brucei	metacaspase	0.0048	0.0244	1
Echinococcus multilocularis	caspase 8	0.0048	0.0244	0.076
Brugia malayi	hypothetical protein	0.0044	0.021	0.0584
Schistosoma mansoni	alpha-galactosidase/alpha-n-acetylgalactosaminidase	0.0221	0.1608	0.5929
Trichomonas vaginalis	Clan CD, family C14, metacaspase-like cysteine peptidase	0.0048	0.0244	0.1015
Trypanosoma brucei	importin beta-1 subunit, putative	0.0031	0.0105	0.3145
Echinococcus multilocularis	SAM and MBT domain containing protein	0.0051	0.0265	0.0839
Echinococcus granulosus	neuroglian	0.005	0.0261	0.0432
Echinococcus granulosus	importin subunit beta 1	0.0031	0.0105	0.0125
Loa Loa (eye worm)	hypothetical protein	0.0193	0.1385	0.3779
Brugia malayi	Pre-SET motif family protein	0.0222	0.1617	0.4497
Toxoplasma gondii	HEAT repeat-containing protein	0.0031	0.0105	0.0407
Trypanosoma cruzi	metacaspase, putative	0.0048	0.0244	1
Brugia malayi	C2-HC type zinc finger protein C.e-MyT1	0.0058	0.0321	0.0891
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0038	0.0165	0.0458
Trichomonas vaginalis	glucosylceramidase, putative	0.0181	0.1291	0.6255
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0032	0.0114	0.047
Mycobacterium tuberculosis	3-dehydroquinate dehydratase AroD (AROQ) (3-dehydroquinase) (type II dhqase)	0.1284	1	1
Trichomonas vaginalis	Clan CD, family C14, metacaspase-like cysteine peptidase	0.0048	0.0244	0.1015
Trichomonas vaginalis	penicillin-binding protein, putative	0.0038	0.0165	0.062
Trypanosoma brucei	hypothetical protein, conserved	0.0038	0.0165	0.6107
Schistosoma mansoni	caspase-7 (C14 family)	0.0128	0.087	0.3207
Echinococcus granulosus	endonuclease exonuclease phosphatase	0.0201	0.1447	0.2755
Echinococcus multilocularis	caspase 3	0.0079	0.0489	0.1678
Schistosoma mansoni	hypothetical protein	0.0327	0.2444	0.9011
Plasmodium falciparum	ataxin-2 like protein, putative	0.0027	0.0075	0.1702
Loa Loa (eye worm)	O-glycosyl hydrolase family 30 protein	0.0276	0.204	0.5622
Plasmodium falciparum	importin beta, putative	0.0031	0.0105	0.3145
Brugia malayi	beta-lactamase family protein	0.0038	0.0165	0.0458
Schistosoma mansoni	importin beta-1	0.0031	0.0105	0.0384
Schistosoma mansoni	ran	0.0023	0.0041	0.0149
Plasmodium vivax	hypothetical protein, conserved	0.0048	0.0244	1
Leishmania major	metacaspase, putative	0.0048	0.0244	1
Echinococcus multilocularis	geminin	0.0361	0.2712	1
Loa Loa (eye worm)	beta-lactamase	0.0038	0.0165	0.0349
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0265	0.063
Trypanosoma cruzi	metacaspase 5, putative	0.0048	0.0244	1
Trichomonas vaginalis	glucosylceramidase, putative	0.0276	0.204	1
Echinococcus granulosus	caspase	0.0128	0.087	0.1624
Echinococcus granulosus	Alpha N acetylgalactosaminidase	0.0221	0.1608	0.307
Toxoplasma gondii	Alpha-galactosidase	0.0031	0.011	0.0441
Plasmodium vivax	ataxin-2 like protein, putative	0.0027	0.0075	0.1702
Echinococcus multilocularis	Glycoside hydrolase, family 27	0.0221	0.1608	0.5868
Trypanosoma brucei	importin beta-1 subunit, putative	0.0031	0.0105	0.3145
Schistosoma mansoni	caspase-3 (C14 family)	0.0128	0.087	0.3207
Schistosoma mansoni	caspase-7 (C14 family)	0.0093	0.0599	0.2206
Schistosoma mansoni	survival motor neuron protein	0.0052	0.0269	0.0992
Schistosoma mansoni	alpha-galactosidase/alpha-n-acetylgalactosaminidase	0.0221	0.1608	0.5929
Onchocerca volvulus	Tyrosine kinase homolog	0.0384	0.2896	0.7986
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0165	0.0349
Trichomonas vaginalis	Clan CD, family C14, metacaspase-like cysteine peptidase	0.0048	0.0244	0.1015
Trichomonas vaginalis	conserved hypothetical protein	0.0048	0.0244	0.1015
Brugia malayi	Immunoglobulin I-set domain containing protein	0.043	0.3257	0.9055
Schistosoma mansoni	myelin transcription factor 1 myt1	0.0058	0.0321	0.1181
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0038	0.0165	0.0464
Trypanosoma brucei	metacaspase MCA2	0.0048	0.0244	1
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0165	0.0349
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0275	0.0659
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0032	0.0114	0.0276
Trypanosoma cruzi	metacaspase, putative	0.0048	0.0244	1
Schistosoma mansoni	sex comb on midleg homolog	0.0051	0.0265	0.0976
Trichomonas vaginalis	D-aminoacylase, putative	0.0038	0.0165	0.062
Trichomonas vaginalis	Clan CD, family C14, metacaspase-like cysteine peptidase	0.0048	0.0244	0.1015
Loa Loa (eye worm)	hypothetical protein	0.0059	0.0326	0.0803
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0025	0.0059	0.0091
Onchocerca volvulus		0.0051	0.0265	0.0432
Brugia malayi	RNA, U transporter 1	0.0087	0.055	0.153
Trichomonas vaginalis	conserved hypothetical protein	0.0048	0.0244	0.1015
Echinococcus multilocularis	Immunoglobulin	0.0044	0.021	0.0634
Onchocerca volvulus	Glucosylceramidase homolog	0.0181	0.1291	0.3379
Trichomonas vaginalis	glucosylceramidase, putative	0.0181	0.1291	0.6255

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 0.27 uM	Inhibition of Flt1 by HTRF assay	ChEMBL.	17391959
IC50 (binding)	= 0.27 uM	Inhibition of Flt1 by HTRF assay	ChEMBL.	17391959
IC50 (binding)	= 0.44 uM	Inhibition of KDR by HTRF assay	ChEMBL.	17391959
IC50 (binding)	= 0.44 uM	Inhibition of KDR by HTRF assay	ChEMBL.	17391959
IC50 (binding)	= 1.67 uM	Inhibition of c-Kit by HTRF assay	ChEMBL.	17391959
IC50 (binding)	= 1.67 uM	Inhibition of c-Kit by HTRF assay	ChEMBL.	17391959

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: CHEMBL246546

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 456019