TDR Targets

Basic information

Technical information

TDR Targets ID: 763688
Name: 2-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-1-(4- propoxyphenyl)-1H-chromeno[2,3-c]pyrrole-3,9- dione
MW: 461.533 | Formula: C25H23N3O4S
H donors: 0 H acceptors: 4 LogP: 4.85 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: CCCOc1ccc(cc1)C1N(c2nnc(s2)C(C)C)C(=O)c2c1c(=O)c1c(o2)cccc1
InChi: 1S/C25H23N3O4S/c1-4-13-31-16-11-9-15(10-12-16)20-19-21(29)17-7-5-6-8-18(17)32-22(19)24(30)28(20)25-27-26-23(33-25)14(2)3/h5-12,14,20H,4,13H2,1-3H3
InChiKey: WAJAXXQHENRGBF-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

2-(5-isopropyl-1,3,4-thiadiazol-2-yl)-1-(4-propoxyphenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione
2-(5-isopropyl-1,3,4-thiadiazol-2-yl)-1-(4-propoxyphenyl)-1H-chromeno[2,3-c]pyrrole-3,9-quinone
NCGC00101351-01

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	TAR DNA binding protein	Starlite/ChEMBL	No references
Escherichia coli	penicillin-binding protein	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Echinococcus multilocularis	tar DNA binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Loa Loa (eye worm)	TAR-binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Schistosoma japonicum	TAR DNA-binding protein 43, putative	Get druggable targets OG5_132461	All targets in OG5_132461
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	Get druggable targets OG5_132461	All targets in OG5_132461
Brugia malayi	RNA recognition motif domain containing protein	Get druggable targets OG5_132461	All targets in OG5_132461
Schistosoma mansoni	tar DNA-binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Schistosoma mansoni	tar DNA-binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Schistosoma japonicum	TAR DNA-binding protein 43, putative	Get druggable targets OG5_132461	All targets in OG5_132461
Mycobacterium tuberculosis	Possible penicillin-binding protein	Get druggable targets OG5_149948	All targets in OG5_149948
Brugia malayi	RNA binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Schistosoma mansoni	tar DNA-binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Schistosoma mansoni	tar DNA-binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Echinococcus granulosus	tar DNA binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Brugia malayi	TAR-binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Loa Loa (eye worm)	RNA binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Schistosoma mansoni	tar DNA-binding protein	Get druggable targets OG5_132461	All targets in OG5_132461

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
Leishmania major	myo-inositol/proton symporter (MIT)	0.0031	0.0217	0.303
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0066	0.0611	0.1245
Plasmodium vivax	hypothetical protein, conserved	0.0043	0.0359	0.0344
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0217	0.0907
Mycobacterium tuberculosis	Conserved protein	0.0043	0.0359	0.1224
Schistosoma mansoni	tar DNA-binding protein	0.0076	0.0722	0.3138
Echinococcus granulosus	solute carrier family 22	0.0031	0.0217	0.042
Mycobacterium ulcerans	prolyl-tRNA synthetase	0.0023	0.0134	0.3243
Trypanosoma cruzi	cytochrome P450, putative	0.0012	0.0012	0.0173
Echinococcus multilocularis	lysyl tRNA synthetase	0.0048	0.0414	0.0832
Echinococcus granulosus	synaptic vesicle 2 protein	0.0031	0.0217	0.042
Toxoplasma gondii	calcium-dependent protein kinase CDPK2A	0.0067	0.0612	0.0925
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0217	0.2266	0.4702
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0067	0.0621	0.868
Trichomonas vaginalis	glucose transporter, putative	0.0067	0.0621	0.274
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0217	0.0907
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0359	0.1538
Brugia malayi	lysyl-tRNA synthetase	0.0048	0.0414	0.1781
Mycobacterium leprae	Possible lysyl-tRNA synthetase 2 LysX	0.0048	0.0414	0.6932
Echinococcus multilocularis	solute carrier family 22	0.0031	0.0217	0.042
Toxoplasma gondii	ABC1 family protein	0.0043	0.0359	0.0542
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0043	0.0359	0.8678
Trichomonas vaginalis	sugar transport protein, putative	0.0031	0.0217	0.0956
Entamoeba histolytica	protein kinase, putative	0.0066	0.0611	1
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Schistosoma mansoni	serine/threonine protein kinase	0.0066	0.0611	0.2648
Mycobacterium tuberculosis	Probable lipase LipD	0.0043	0.0359	0.1224
Loa Loa (eye worm)	CAMK/CAMK2 protein kinase	0.0066	0.0611	0.2659
Loa Loa (eye worm)	hypothetical protein	0.0048	0.0414	0.1781
Trichomonas vaginalis	CAMK family protein kinase	0.0066	0.0611	0.2699
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0066	0.0611	0.1245
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0217	0.0907
Schistosoma mansoni	sugar transporter	0.0031	0.0217	0.0894
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Plasmodium falciparum	lysine--tRNA ligase	0.0048	0.0414	0.0399
Trichomonas vaginalis	lysyl-tRNA synthetase, putative	0.0048	0.0414	0.1826
Brugia malayi	Bifunctional aminoacyl-tRNA synthetase	0.0065	0.0597	0.2594
Trypanosoma brucei	glycyl-tRNA synthetase, putative	0.0012	0.0016	0.0218
Echinococcus granulosus	solute carrier family 22	0.0031	0.0217	0.042
Echinococcus multilocularis	tar DNA binding protein	0.0076	0.0722	0.1475
Echinococcus granulosus	solute carrier family 22	0.0031	0.0217	0.042
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0043	0.0359	0.1224
Brugia malayi	Sugar transporter family protein	0.0031	0.0217	0.0907
Giardia lamblia	Sugar-proton symporter	0.0031	0.0217	0.346
Echinococcus multilocularis	calcium dependent protein kinase	0.0062	0.0566	0.1151
Loa Loa (eye worm)	major facilitator superfamily transporter	0.0031	0.0217	0.0907
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Brugia malayi	Major Facilitator Superfamily protein	0.0031	0.0217	0.0907
Plasmodium falciparum	proline--tRNA ligase	0.0076	0.0715	0.0701
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0217	0.0907
Brugia malayi	beta-lactamase	0.0043	0.0359	0.1538
Leishmania major	protein kinase, putative	0.0066	0.0611	0.855
Trichomonas vaginalis	conserved hypothetical protein	0.0031	0.0217	0.0956
Loa Loa (eye worm)	TAR-binding protein	0.0076	0.0722	0.3147
Trypanosoma cruzi	hypothetical protein, conserved	0.0043	0.0359	0.5019
Trypanosoma brucei	bifunctional aminoacyl-tRNA synthetase, putative	0.0076	0.0715	1
Plasmodium falciparum	hexose transporter	0.0217	0.2266	0.2253
Schistosoma mansoni	tar DNA-binding protein	0.0076	0.0722	0.3138
Mycobacterium ulcerans	lysyl-tRNA synthetase	0.0048	0.0414	1
Schistosoma mansoni	lysyl-tRNA synthetase	0.0048	0.0414	0.1769
Trichomonas vaginalis	sugar transporter, putative	0.0067	0.0621	0.274
Echinococcus multilocularis	solute carrier family 22	0.0031	0.0217	0.042
Trichomonas vaginalis	esterase, putative	0.0043	0.0359	0.1584
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0359	0.1538
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0016	0.0015
Brugia malayi	Major Facilitator Superfamily protein	0.0031	0.0217	0.0907
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0217	0.0907
Plasmodium falciparum	calcium-dependent protein kinase 1	0.0067	0.0612	0.0597
Onchocerca volvulus		0.0043	0.0359	1
Trypanosoma brucei	glucose transporter, putative	0.0067	0.0621	0.868
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0066	0.0611	0.1245
Loa Loa (eye worm)	sugar transporter	0.0031	0.0217	0.0907
Brugia malayi	major facilitator superfamily protein	0.0031	0.0217	0.0907
Schistosoma mansoni	tar DNA-binding protein	0.0076	0.0722	0.3138
Trichomonas vaginalis	prolyl-tRNA synthetase, putative	0.0065	0.0597	0.2634
Mycobacterium ulcerans	esterase/lipase LipP	0.0043	0.0359	0.8678
Trichomonas vaginalis	lysyl-tRNA synthetase, putative	0.0042	0.0348	0.1536
Trypanosoma cruzi	threonyl-tRNA synthetase, putative	0.0012	0.0016	0.0218
Toxoplasma gondii	transporter, major facilitator family protein	0.0031	0.0217	0.0327
Mycobacterium ulcerans	integral membrane transport protein	0.0031	0.0217	0.5239
Schistosoma mansoni	hypothetical protein	0.0165	0.1696	0.7471
Leishmania major	hypothetical protein, conserved	0.0031	0.0217	0.303
Mycobacterium leprae	Probable prolyl tRNA synthetase ProS	0.0065	0.0597	1
Toxoplasma gondii	glycyl-tRNA synthetase	0.0012	0.0016	0.0024
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Mycobacterium tuberculosis	Probable dicarboxylic acid transport integral membrane protein KgtP (dicarboxylate transporter)	0.0031	0.0217	0.0739
Giardia lamblia	Prolyl-tRNA synthetase	0.0065	0.0597	1
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Plasmodium vivax	calcium-dependent protein kinase 1, putative	0.0067	0.0612	0.0597
Echinococcus granulosus	General substrate transporter	0.0187	0.193	0.4001
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0066	0.0611	0.1245
Trypanosoma brucei	glucose transporter 1E	0.0067	0.0621	0.868
Schistosoma mansoni	protein kinase	0.0066	0.0611	0.2648
Loa Loa (eye worm)	hypothetical protein	0.0066	0.0611	0.2659
Schistosoma mansoni	protein kinase	0.0066	0.0611	0.2648
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0066	0.0611	0.1245
Trypanosoma cruzi	hexose transporter, putative	0.0067	0.0621	0.868
Trypanosoma cruzi	cytochrome P450, putative	0.0012	0.0012	0.0173
Plasmodium falciparum	calcium-dependent protein kinase 4	0.0067	0.0612	0.0597
Plasmodium falciparum	calcium-dependent protein kinase 5	0.0067	0.0612	0.0597
Trypanosoma brucei	cytochrome P450, putative	0.0012	0.0012	0.0173
Schistosoma mansoni	hypothetical protein	0.0217	0.2266	1
Loa Loa (eye worm)	major facilitator superfamily transporter	0.0031	0.0217	0.0907
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0043	0.0359	0.0717
Chlamydia trachomatis	lysine--tRNA ligase	0.0048	0.0414	1
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Trypanosoma brucei	sugar transporter, putative	0.0031	0.0217	0.303
Echinococcus multilocularis	geminin	0.0165	0.1696	0.3513
Trichomonas vaginalis	threonyl-tRNA synthetase, putative	0.0012	0.0016	0.0069
Schistosoma mansoni	glucose transporter	0.0031	0.0217	0.0894
Wolbachia endosymbiont of Brugia malayi	major facilitator superfamily permease	0.0031	0.0217	1
Mycobacterium tuberculosis	Conserved protein	0.0043	0.0359	0.1224
Mycobacterium ulcerans	threonyl-tRNA synthetase	0.0012	0.0016	0.0377
Loa Loa (eye worm)	hypothetical protein	0.0065	0.0597	0.2594
Brugia malayi	Calcium/calmodulin-dependent protein kinase type II alpha chain	0.0066	0.0611	0.2659
Onchocerca volvulus		0.0043	0.0359	1
Plasmodium vivax	proline--tRNA ligase, putative	0.0076	0.0715	0.0701
Trypanosoma brucei	calcium/calmodulin-dependent protein kinase, putative	0.0066	0.0611	0.855
Loa Loa (eye worm)	bifunctional aminoacyl-tRNA synthetase	0.0027	0.0175	0.0722
Trichomonas vaginalis	conserved hypothetical protein	0.0031	0.0217	0.0956
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Trichomonas vaginalis	conserved hypothetical protein	0.0031	0.0217	0.0956
Plasmodium vivax	hexose transporter	0.0217	0.2266	0.2253
Loa Loa (eye worm)	threonyl-tRNA synthetase	0.0012	0.0016	0.0015
Echinococcus multilocularis	solute carrier family 2, facilitated glucose	0.0217	0.2266	0.4702
Echinococcus granulosus	solute carrier family 22	0.0031	0.0217	0.042
Entamoeba histolytica	protein kinase, putative	0.0066	0.0611	1
Echinococcus multilocularis	neuropeptide s receptor	0.0448	0.4801	1
Brugia malayi	RNA binding protein	0.0076	0.0722	0.3147
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Mycobacterium leprae	conserved hypothetical protein	0.0043	0.0359	0.6015
Toxoplasma gondii	sugar transporter ST1	0.0031	0.0217	0.0327
Loa Loa (eye worm)	hypothetical protein	0.0065	0.0597	0.2594
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0359	0.1538
Echinococcus multilocularis	synaptic vesicle 2 protein	0.0031	0.0217	0.042
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0217	0.0907
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0359	0.1538
Trichomonas vaginalis	glucose transporter, putative	0.0031	0.0217	0.0956
Trypanosoma brucei	glucose transporter, putative	0.0067	0.0621	0.868
Mycobacterium tuberculosis	Probable threonyl-tRNA synthetase ThrS (threonine-tRNA synthetase)(ThrRS) (threonine-tRNA ligase)	0.0012	0.0016	0.0053
Trichomonas vaginalis	sugar transporter, putative	0.0067	0.0621	0.274
Schistosoma mansoni	glucose transport protein	0.0217	0.2266	1
Toxoplasma gondii	calcium-dependent protein kinase CDPK2B	0.0067	0.0612	0.0925
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0359	0.1538
Giardia lamblia	Hexose transporter	0.0031	0.0217	0.346
Schistosoma mansoni	protein kinase	0.0066	0.0611	0.2648
Trypanosoma brucei	glucose transporter, putative	0.0067	0.0621	0.868
Echinococcus granulosus	calcium dependent protein kinase	0.0062	0.0566	0.1151
Trypanosoma brucei	glucose transporter, putative	0.0067	0.0621	0.868
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0043	0.0359	0.1526
Echinococcus multilocularis	solute carrier family 22	0.0031	0.0217	0.042
Toxoplasma gondii	lysine-tRNA ligase	0.0048	0.0414	0.0625
Toxoplasma gondii	facilitative glucose transporter GT1	0.0217	0.2266	0.3424
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0217	0.0907
Brugia malayi	Sugar transporter family protein	0.0031	0.0217	0.0907
Plasmodium vivax	lysine--tRNA ligase, putative	0.0048	0.0414	0.0399
Schistosoma mansoni	hypothetical protein	0.0165	0.1696	0.7471
Trypanosoma cruzi	hexose transporter, putative	0.0031	0.0217	0.303
Leishmania major	cytochrome p450-like protein	0.0012	0.0012	0.0173
Mycobacterium tuberculosis	Probable esterase LipL	0.0043	0.0359	0.1224
Brugia malayi	Cam kinase protein 1	0.0066	0.0611	0.2659
Schistosoma mansoni	glucose transport protein	0.0217	0.2266	1
Plasmodium vivax	calcium-dependent protein kinase, putative	0.0067	0.0612	0.0597
Schistosoma mansoni	sugar transporter	0.0031	0.0217	0.0894
Leishmania major	prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative	0.0076	0.0715	1
Toxoplasma gondii	threonyl-tRNA synthetase family protein	0.0012	0.0016	0.0024
Loa Loa (eye worm)	RNA binding protein	0.0076	0.0722	0.3147
Plasmodium vivax	mitogen-activated protein kinase 2, putative	0.0351	0.3734	0.3724
Plasmodium falciparum	protein kinase 7	0.0613	0.6617	0.6612
Schistosoma mansoni	tar DNA-binding protein	0.0076	0.0722	0.3138
Trypanosoma cruzi	hexose transporter, putative	0.0037	0.0286	0.3994
Mycobacterium leprae	Probable threonyl-tRNA synthetase ThrS (threonine-tRNA synthetase) (ThrRS) (Threonine-tRNA ligase)	0.0012	0.0016	0.0262
Mycobacterium leprae	Probable lysyl-tRNA synthase LysS (lysine--tRNA ligase 1) (LysRS 1) (lysine translase)	0.0041	0.0333	0.5587
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Echinococcus granulosus	beta LACTamase domain containing family member	0.0043	0.0359	0.0717
Trypanosoma cruzi	prolyl-tRNA synthetase, putative	0.0076	0.0715	1
Toxoplasma gondii	sugar transporter ST3	0.0031	0.0217	0.0327
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Plasmodium falciparum	calcium-dependent protein kinase 2	0.0067	0.0612	0.0597
Toxoplasma gondii	prolyl-tRNA synthetase (ProRS)	0.0076	0.0715	0.1081
Schistosoma mansoni	glucose transport protein	0.0217	0.2266	1
Toxoplasma gondii	cell-cycle-associated protein kinase MAPK, putative	0.0351	0.3734	0.5643
Trypanosoma cruzi	threonyl-tRNA synthetase, putative	0.0012	0.0016	0.0218
Trypanosoma cruzi	glucose transporter, putative	0.0031	0.0217	0.303
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0076	0.0722	0.3147
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0043	0.0359	0.1224
Brugia malayi	RNA recognition motif domain containing protein	0.0076	0.0722	0.3147
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Mycobacterium ulcerans	lipase LipD	0.0043	0.0359	0.8678
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Plasmodium vivax	calcium-dependent protein kinase 4, putative	0.0067	0.0612	0.0597
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0043	0.0359	0.1526
Leishmania major	lysyl-tRNA synthetase, putative	0.0048	0.0414	0.5783
Onchocerca volvulus		0.0043	0.0359	1
Loa Loa (eye worm)	calcium/calmodulin-dependent protein kinase ID	0.0066	0.0611	0.2659
Echinococcus multilocularis	solute carrier family 22	0.0031	0.0217	0.042
Trypanosoma brucei	threonyl-tRNA synthetase, putative	0.0012	0.0016	0.0218
Leishmania major	threonyl-tRNA synthetase, putative	0.0012	0.0016	0.0218
Mycobacterium ulcerans	lysyl-tRNA synthetase	0.0048	0.0414	1
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Leishmania major	glucose transporter, lmgt3	0.0067	0.0621	0.868
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0066	0.0611	0.1245
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0067	0.0621	0.868
Echinococcus granulosus	glutamyl tRNA synthetase cytoplasmic	0.0065	0.0597	0.1214
Mycobacterium ulcerans	fusion protein of transposase for IS2606 and sialic acid-transport integral membrane protein NanT	0.0031	0.0217	0.5239
Mycobacterium tuberculosis	Probable lipase LipE	0.0043	0.0359	0.1224
Mycobacterium ulcerans	beta-lactamase	0.0043	0.0359	0.8678
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0217	0.0907
Trichomonas vaginalis	conserved hypothetical protein	0.0067	0.0621	0.274
Leishmania major	glucose transporter/membrane transporter D2, putative	0.0067	0.0621	0.868
Trichomonas vaginalis	glucose transporter, putative	0.0067	0.0621	0.274
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type 1	0.0066	0.0611	0.1245
Mycobacterium tuberculosis	Conserved protein	0.0043	0.0359	0.1224
Trichomonas vaginalis	conserved hypothetical protein	0.0031	0.0217	0.0956
Brugia malayi	hypothetical protein	0.0031	0.0217	0.0907
Schistosoma mansoni	nuclear transcription factor X-box binding 1 (nfx1)	0.0031	0.0217	0.0894
Brugia malayi	beta-lactamase family protein	0.0043	0.0359	0.1538
Trypanosoma cruzi	hypothetical protein, conserved	0.0043	0.0359	0.5019
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0067	0.0621	0.868
Mycobacterium leprae	Probable lipase LipE	0.0043	0.0359	0.6015
Trypanosoma cruzi	hexose transporter, putative	0.0067	0.0621	0.868
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0217	0.2266	0.4702
Echinococcus multilocularis	Sugar transporter ERD6 protein	0.0031	0.0217	0.042
Trichomonas vaginalis	myo-inositol transporter, putative	0.0031	0.0217	0.0956
Trypanosoma cruzi	lysyl-tRNA synthetase, putative	0.0048	0.0414	0.5783
Trichomonas vaginalis	conserved hypothetical protein	0.0217	0.2266	1
Mycobacterium ulcerans	sugar transporter	0.0031	0.0217	0.5239
Brugia malayi	threonyl-tRNA synthetase, cytoplasmic	0.0012	0.0016	0.0015
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0217	0.0907
Mycobacterium tuberculosis	Lysyl-tRNA synthetase 1 LysS (lysine--tRNA ligase 1) (LysRS 1) (lysine translase)	0.0041	0.0333	0.1137
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Trichomonas vaginalis	D-aminoacylase, putative	0.0043	0.0359	0.1584
Trichomonas vaginalis	penicillin-binding protein, putative	0.0043	0.0359	0.1584
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0217	0.0907
Echinococcus multilocularis	neuropeptide receptor A26	0.0448	0.4801	1
Giardia lamblia	Lysyl-tRNA synthetase	0.0048	0.0414	0.6849
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Trypanosoma brucei	glucose transporter, putative	0.0067	0.0621	0.868
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Trichomonas vaginalis	D-aminoacylase, putative	0.0043	0.0359	0.1584
Schistosoma mansoni	sugar transporter	0.0031	0.0217	0.0894
Plasmodium vivax	calcium-dependent protein kinase 3, putative	0.0067	0.0612	0.0597
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Trypanosoma cruzi	hexose transporter	0.0067	0.0621	0.868
Trichomonas vaginalis	conserved hypothetical protein	0.0067	0.0621	0.274
Loa Loa (eye worm)	sugar transporter	0.0217	0.2266	1
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Mycobacterium tuberculosis	Probable hydrolase	0.0043	0.0359	0.1224
Treponema pallidum	prolyl-tRNA synthetase	0.0023	0.0134	1
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0217	0.0907
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0217	0.0907
Plasmodium falciparum	major facilitator superfamily domain-containing protein, putative	0.0031	0.0217	0.0201
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0217	0.2266	0.4702
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Brugia malayi	beta-lactamase family protein	0.0043	0.0359	0.1538
Plasmodium vivax	CDK-related protein kinase 6, putative	0.0921	1	1
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0217	0.2266	0.4702
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0217	0.0907
Mycobacterium tuberculosis	Lysyl-tRNA synthetase 2 LysX	0.0041	0.0333	0.1137
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0217	0.2266	0.4702
Toxoplasma gondii	calcium-dependent protein kinase CDPK3	0.0067	0.0612	0.0925
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0278	0.2932	1
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0217	0.0907
Plasmodium vivax	sugar transporter, putative	0.0031	0.0217	0.0201
Mycobacterium tuberculosis	Probable conserved integral membrane transport protein	0.0031	0.0217	0.0739
Schistosoma mansoni	sugar transporter	0.0031	0.0217	0.0894
Trypanosoma cruzi	sugar transporter, putative	0.0031	0.0217	0.303
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0066	0.0611	0.1245
Entamoeba histolytica	prolyl-tRNA synthetase, putative	0.0065	0.0597	0.9752
Mycobacterium ulcerans	cytochrome P450 185A4 Cyp185A4	0.0012	0.0012	0.0298
Brugia malayi	bifunctional aminoacyl-tRNA synthetase	0.0065	0.0597	0.2594
Schistosoma mansoni	glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs)	0.0065	0.0597	0.2583
Loa Loa (eye worm)	hypothetical protein	0.0053	0.0463	0.1998
Trypanosoma cruzi	prolyl-tRNA synthetase, putative	0.0076	0.0715	1
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Leishmania major	prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative	0.0076	0.0715	1
Trypanosoma brucei	glucose transporter, putative	0.0067	0.0621	0.868
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0359	0.1538
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Leishmania major	hypothetical protein, conserved	0.0043	0.0359	0.5019
Echinococcus granulosus	geminin	0.0165	0.1696	0.3513
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Trypanosoma brucei	myo-inositol/proton symporter (MIT)	0.0031	0.0217	0.303
Leishmania major	glucose transporter, lmgt2	0.0067	0.0621	0.868
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0043	0.0359	0.1224
Trypanosoma brucei	glucose transporter 2A	0.0067	0.0621	0.868
Echinococcus granulosus	Sugar transporter ERD6 protein	0.0031	0.0217	0.042
Echinococcus granulosus	lysyl tRNA synthetase	0.0048	0.0414	0.0832
Trypanosoma cruzi	hexose transporter, putative	0.0067	0.0621	0.868
Echinococcus granulosus	tar DNA binding protein	0.0076	0.0722	0.1475
Brugia malayi	TAR-binding protein	0.0076	0.0722	0.3147
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Echinococcus granulosus	neuropeptide receptor A26	0.0448	0.4801	1
Brugia malayi	probable proline-trna synthetase - fission yeast, putative	0.0012	0.0016	0.0015
Schistosoma mansoni	lysyl-tRNA synthetase	0.0048	0.0414	0.1769
Brugia malayi	hypothetical protein	0.0031	0.0217	0.0907
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0217	0.2266	0.4702
Trypanosoma brucei	glucose transporter, putative	0.0067	0.0621	0.868
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0217	0.0907
Trichomonas vaginalis	conserved hypothetical protein	0.0031	0.0217	0.0956
Brugia malayi	glycyl-tRNA synthetase	0.0012	0.0016	0.0015
Brugia malayi	hypothetical protein	0.0031	0.0217	0.0907
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0043	0.0359	0.1538
Entamoeba histolytica	hypothetical protein	0.0048	0.0414	0.6679
Toxoplasma gondii	sugar transporter ST2	0.0031	0.0217	0.0327
Schistosoma mansoni	tar DNA-binding protein	0.0076	0.0722	0.3138
Trichomonas vaginalis	sugar transporter, putative	0.0067	0.0621	0.274
Loa Loa (eye worm)	glycyl-tRNA synthetase	0.0012	0.0016	0.0015
Toxoplasma gondii	protein kinase, putative	0.0613	0.6617	1
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Trypanosoma brucei	glucose transporter, putative	0.0067	0.0621	0.868
Mycobacterium ulcerans	glycyl-tRNA synthetase	0.0012	0.0016	0.0377
Brugia malayi	Major Facilitator Superfamily protein	0.0031	0.0217	0.0907
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0043	0.0359	0.1538
Schistosoma mansoni	glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs)	0.0065	0.0597	0.2583
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Loa Loa (eye worm)	beta-lactamase	0.0043	0.0359	0.1538
Echinococcus multilocularis	glutamyl tRNA synthetase cytoplasmic	0.0065	0.0597	0.1214
Mycobacterium ulcerans	sugar-transport integral membrane protein SugI	0.0031	0.0217	0.5239
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Brugia malayi	Sugar transporter family protein	0.0217	0.2266	1
Trypanosoma brucei	lysyl-tRNA synthetase, putative	0.0048	0.0414	0.5783
Brugia malayi	major facilitator superfamily protein	0.0031	0.0217	0.0907
Mycobacterium ulcerans	hypothetical protein	0.0043	0.0359	0.8678
Leishmania major	glucose transporter, lmgt1	0.0067	0.0621	0.868
Trichomonas vaginalis	sugar transporter, putative	0.0031	0.0217	0.0956
Echinococcus multilocularis	General substrate transporter	0.0187	0.193	0.4001
Echinococcus granulosus	neuropeptide s receptor	0.0448	0.4801	1
Plasmodium falciparum	calcium-dependent protein kinase 3	0.0067	0.0612	0.0597
Trypanosoma brucei	hypothetical protein, conserved	0.0043	0.0359	0.5019
Plasmodium falciparum	mitogen-activated protein kinase 2	0.0351	0.3734	0.3724
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0217	0.2266	0.4702
Chlamydia trachomatis	proline--tRNA ligase	0.0023	0.0134	0.2978
Trichomonas vaginalis	penicillin-binding protein, putative	0.0043	0.0359	0.1584
Trichomonas vaginalis	D-aminoacylase, putative	0.0043	0.0359	0.1584

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	= 3.5481 um	PUBCHEM_BIOASSAY: qHTS Inhibitors of AmpC Beta-Lactamase (assay with detergent). (Class of assay: confirmatory) [Related pubchem assays: 1002 (Confirmation Concentration-Response Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent)), 585 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay without detergent) - a screen old NIH MLSMR collection), 584 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay with detergent) - a screen of the old NIH MLSMR collection), 1003 (Confirmation Cuvette-Based Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent))]	ChEMBL.	No reference
Potency (functional)	19.9526 uM	PubChem BioAssay. qHTS of TDP-43 Inhibitors. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	25.1189 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)	100 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623]	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: CHEMBL1316481
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Bibliographic References

No literature references available for this target.

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Detailed information for compound 763688