TDR Targets

Basic information

Technical information

TDR Targets ID: 1126421
Name: [(2S,3aS,7aS)-2-(pyrrole-1-carbonyl)-2,3,3a,4 ,5,6,7,7a-octahydroindol-1-yl]-[(1R,2R)-2-phe nylcyclopropyl]methanone
MW: 362.465 | Formula: C23H26N2O2
H donors: 0 H acceptors: 2 LogP: 3.8 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: O=C([C@@H]1C[C@H]1c1ccccc1)N1[C@H]2CCCC[C@H]2C[C@H]1C(=O)n1cccc1
InChi: 1S/C23H26N2O2/c26-22(19-15-18(19)16-8-2-1-3-9-16)25-20-11-5-4-10-17(20)14-21(25)23(27)24-12-6-7-13-24/h1-3,6-9,12-13,17-21H,4-5,10-11,14-15H2/t17-,18-,19+,20-,21-/m0/s1
InChiKey: MASOCVYRNDTIKP-WHZJULEDSA-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

[(2S,3aS,7aS)-2-[oxo-(1-pyrrolyl)methyl]-2,3,3a,4,5,6,7,7a-octahydroindol-1-yl]-[(1R,2R)-2-phenylcyclopropyl]methanone
[(2S,3aS,7aS)-2-pyrrol-1-ylcarbonyl-2,3,3a,4,5,6,7,7a-octahydroindol-1-yl]-[(1R,2R)-2-phenylcyclopropyl]methanone

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Rattus norvegicus	Prolyl endopeptidase	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Echinococcus multilocularis	prolyl endopeptidase	Get druggable targets OG5_129295	All targets in OG5_129295
Brugia malayi	prolyl oligopeptidase family protein	Get druggable targets OG5_129295	All targets in OG5_129295
Schistosoma japonicum	ko:K01322 prolyl oligopeptidase [EC3.4.21.26], putative	Get druggable targets OG5_129295	All targets in OG5_129295
Trypanosoma congolense	prolyl endopeptidase	Get druggable targets OG5_129295	All targets in OG5_129295
Onchocerca volvulus	Prolyl endopeptidase homolog	Get druggable targets OG5_129295	All targets in OG5_129295
Schistosoma mansoni	prolyl oligopeptidase (S09 family)	Get druggable targets OG5_129295	All targets in OG5_129295
Leishmania mexicana	prolyl oligopeptidase, putative	Get druggable targets OG5_129295	All targets in OG5_129295
Leishmania infantum	prolyl oligopeptidase, putative,serine peptidase clan SC, family S9A, putative	Get druggable targets OG5_129295	All targets in OG5_129295
Trypanosoma brucei	prolyl endopeptidase	Get druggable targets OG5_129295	All targets in OG5_129295
Toxoplasma gondii	prolyl endopeptidase	Get druggable targets OG5_129295	All targets in OG5_129295
Trypanosoma brucei gambiense	prolyl oligopeptidase, putative,serine peptidase clan SC, family S9A, putative	Get druggable targets OG5_129295	All targets in OG5_129295
Schistosoma mansoni	prolyl oligopeptidase (S09 family)	Get druggable targets OG5_129295	All targets in OG5_129295
Mycobacterium tuberculosis	Probable protease II PtrBa [first part] (oligopeptidase B)	Get druggable targets OG5_129295	All targets in OG5_129295
Neospora caninum	Prolyl oligopeptidase (EC 3.4.21.26) (Precursor), related	Get druggable targets OG5_129295	All targets in OG5_129295
Schistosoma japonicum	Prolyl endopeptidase, putative	Get druggable targets OG5_129295	All targets in OG5_129295
Leishmania major	prolyl oligopeptidase, putative,serine peptidase clan SC, family S9A, putative	Get druggable targets OG5_129295	All targets in OG5_129295
Leishmania donovani	prolyl endopeptidase	Get druggable targets OG5_129295	All targets in OG5_129295
Trypanosoma cruzi	prolyl endopeptidase	Get druggable targets OG5_129295	All targets in OG5_129295
Echinococcus granulosus	prolyl endopeptidase	Get druggable targets OG5_129295	All targets in OG5_129295
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_129295	All targets in OG5_129295

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Trypanosoma brucei	oligopeptidase b	Prolyl endopeptidase	710 aa	626 aa	27.2 %
Mycobacterium ulcerans	protease II (oligopeptidase B), PtrB	Prolyl endopeptidase	710 aa	713 aa	26.4 %
Leishmania infantum	oligopeptidase b;with=GeneDB:LmjF09.0770	Prolyl endopeptidase	710 aa	720 aa	25.1 %
Leishmania major	oligopeptidase b	Prolyl endopeptidase	710 aa	718 aa	25.2 %
Leishmania donovani	oligopeptidase b	Prolyl endopeptidase	710 aa	720 aa	25.1 %
Trypanosoma brucei gambiense	oligopeptidase B, putative	Prolyl endopeptidase	710 aa	626 aa	27.2 %
Dictyostelium discoideum	oligopeptidase B	Prolyl endopeptidase	710 aa	716 aa	23.3 %
Trypanosoma cruzi	oligopeptidase b	Prolyl endopeptidase	710 aa	719 aa	25.7 %
Trypanosoma congolense	oligopeptidase b	Prolyl endopeptidase	710 aa	588 aa	27.6 %
Leishmania braziliensis	oligopeptidase b;with=GeneDB:LmjF09.0770	Prolyl endopeptidase	710 aa	600 aa	25.7 %
Trypanosoma cruzi	oligopeptidase b	Prolyl endopeptidase	710 aa	719 aa	25.7 %
Onchocerca volvulus		Prolyl endopeptidase	710 aa	724 aa	46.7 %
Leishmania mexicana	oligopeptidase b,serine peptidase, clan SC, family S9A-like protein	Prolyl endopeptidase	710 aa	723 aa	24.6 %
Mycobacterium leprae	PROBABLE PROTEASE II PTRBB (OLIGOPEPTIDASE B)	Prolyl endopeptidase	710 aa	735 aa	25.6 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0095	0.1541	0.1541
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0367	0.0367
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0038	0.0367	0.0692
Schistosoma mansoni	prolyl oligopeptidase (S09 family)	0.0158	0.2835	0.3862
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0244	0.4596	1
Brugia malayi	beta-lactamase	0.0038	0.0367	0.0367
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0061	0.0833	0.1135
Leishmania major	prolyl oligopeptidase, putative,serine peptidase clan SC, family S9A, putative	0.0158	0.2835	0.4964
Loa Loa (eye worm)	hypothetical protein	0.0056	0.0727	0.0727
Mycobacterium tuberculosis	Probable lipase LipE	0.0038	0.0367	0.0692
Schistosoma mansoni	glutaminase	0.0316	0.6075	0.8275
Leishmania major	aldehyde dehydrogenase, mitochondrial precursor	0.0184	0.3373	0.5922
Toxoplasma gondii	ABC1 family protein	0.0038	0.0367	0.0947
Brugia malayi	beta-lactamase family protein	0.0038	0.0367	0.0367
Trypanosoma cruzi	serine peptidase, clan SC, family S9A-like protein, putative	0.0063	0.0876	0.1397
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0095	0.1541	0.1541
Onchocerca volvulus		0.0061	0.0833	0.051
Mycobacterium tuberculosis	Probable lipase LipD	0.0038	0.0367	0.0692
Plasmodium falciparum	ataxin-2 like protein, putative	0.0025	0.0099	1
Mycobacterium ulcerans	hypothetical protein	0.0038	0.0367	0.0522
Trypanosoma cruzi	hypothetical protein, conserved	0.0038	0.0367	0.0482
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0095	0.1541	0.1541
Trypanosoma brucei	hypothetical protein, conserved	0.0038	0.0367	0.0561
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0184	0.3373	0.5513
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0095	0.1541	0.21
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0038	0.0367	0.05
Leishmania major	oligopeptidase b	0.0063	0.0876	0.1468
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0038	0.0367	0.0367
Brugia malayi	aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase	0.0081	0.1255	0.1255
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0061	0.0833	0.1135
Brugia malayi	hypothetical protein	0.0025	0.0099	0.0099
Trypanosoma brucei	prolyl endopeptidase	0.0158	0.2835	0.4964
Mycobacterium tuberculosis	Probable esterase LipL	0.0038	0.0367	0.0692
Plasmodium vivax	SET domain protein, putative	0.0061	0.0833	1
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0424	0.8306	0.8306
Trichomonas vaginalis	glutaminase, putative	0.0316	0.6075	0.6387
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0061	0.0833	0.2352
Trypanosoma cruzi	prolyl endopeptidase	0.0158	0.2835	0.4921
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0095	0.1541	0.21
Echinococcus multilocularis	prolyl endopeptidase	0.0158	0.2835	0.2835
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0038	0.0367	0.0367
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0061	0.0833	0.0833
Echinococcus multilocularis	aldehyde dehydrogenase, mitochondrial	0.0184	0.3373	0.3373
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0038	0.0367	0.05
Echinococcus multilocularis	L aminoadipate semialdehyde	0.0081	0.1255	0.1255
Mycobacterium ulcerans	protease II (oligopeptidase B), PtrB	0.0063	0.0876	0.1367
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0056	0.0727	0.0727
Trypanosoma brucei	prolyl oligopeptidase, putative	0.0063	0.0876	0.1468
Echinococcus granulosus	aldehyde dehydrogenase mitochondrial	0.0184	0.3373	0.3373
Brugia malayi	latrophilin 2 splice variant baaae	0.0038	0.0364	0.0364
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.004	0.0399	0.0399
Echinococcus multilocularis	geminin	0.0377	0.7341	0.7341
Schistosoma mansoni	matrix metallopeptidase-9 (M10 family)	0.0037	0.0334	0.0455
Wolbachia endosymbiont of Brugia malayi	4'-phosphopantetheinyl transferase	0.0023	0.0053	0.5
Schistosoma mansoni	hypothetical protein	0.004	0.0399	0.0544
Trichomonas vaginalis	D-aminoacylase, putative	0.0038	0.0367	0.0386
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0038	0.0367	0.0692
Schistosoma mansoni	hypothetical protein	0.0377	0.7341	1
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0061	0.0833	0.1135
Trypanosoma brucei	PAB1-binding protein , putative	0.0025	0.0099	0.0083
Trypanosoma cruzi	mitochondrial DNA polymerase beta-PAK, putative	0.0051	0.0624	0.0943
Schistosoma mansoni	aminoadipate-semialdehyde dehydrogenase	0.0081	0.1255	0.1709
Schistosoma mansoni	hypothetical protein	0.0038	0.0364	0.0496
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0038	0.0367	0.0692
Loa Loa (eye worm)	hypothetical protein	0.025	0.4717	0.4717
Mycobacterium tuberculosis	Probable protease II PtrBb [second part] (oligopeptidase B)	0.0063	0.0876	0.1812
Onchocerca volvulus	Prolyl endopeptidase homolog	0.0158	0.2835	0.2699
Schistosoma mansoni	transcription factor LCR-F1	0.004	0.0399	0.0544
Mycobacterium tuberculosis	Conserved protein	0.0038	0.0367	0.0692
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0059	0.0787	0.0787
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0184	0.3373	0.5513
Trichomonas vaginalis	D-aminoacylase, putative	0.0038	0.0367	0.0386
Plasmodium falciparum	ataxin-2 like protein, putative	0.0025	0.0099	1
Chlamydia trachomatis	holo [acyl-carrier protein] synthase	0.0023	0.0053	0.5
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0056	0.0727	0.0727
Mycobacterium tuberculosis	Conserved protein	0.0038	0.0367	0.0692
Loa Loa (eye worm)	hypothetical protein	0.0158	0.2835	0.2835
Leishmania major	hypothetical protein, conserved	0.0025	0.0099	0.0083
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0099	0.0099
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0038	0.0367	0.0522
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0095	0.1541	0.1541
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.004	0.0399	0.0399
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0061	0.0833	0.0833
Brugia malayi	glutaminase DH11.1	0.0316	0.6075	0.6075
Trypanosoma cruzi	oligopeptidase b	0.0063	0.0876	0.1397
Onchocerca volvulus	Huntingtin homolog	0.025	0.4717	0.4758
Mycobacterium tuberculosis	Probable aldehyde dehydrogenase	0.0184	0.3373	0.7308
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0056	0.0727	0.0727
Mycobacterium ulcerans	hypothetical protein	0.0156	0.2783	0.4534
Trypanosoma cruzi	oligopeptidase b	0.0063	0.0876	0.1397
Schistosoma mansoni	hypothetical protein	0.0377	0.7341	1
Trypanosoma cruzi	oligopeptidase B-like protein, putative	0.0063	0.0876	0.1397
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0367	0.0367
Loa Loa (eye worm)	hypothetical protein	0.0081	0.1255	0.1255
Trypanosoma cruzi	DNA polymerase beta thumb, putative	0.0042	0.0437	0.0607
Trichomonas vaginalis	D-aminoacylase, putative	0.0038	0.0367	0.0386
Trichomonas vaginalis	set domain proteins, putative	0.0483	0.9511	1
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0367	0.0367
Trypanosoma cruzi	mitochondrial DNA polymerase beta-PAK, putative	0.014	0.2458	0.4243
Echinococcus multilocularis	expressed protein	0.0395	0.7718	0.7718
Echinococcus multilocularis	survival motor neuron protein 1	0.0506	1	1
Loa Loa (eye worm)	glutaminase	0.0316	0.6075	0.6075
Trichomonas vaginalis	esterase, putative	0.0038	0.0367	0.0386
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0061	0.0833	0.1135
Echinococcus granulosus	expressed protein	0.0395	0.7718	0.7718
Mycobacterium ulcerans	esterase/lipase LipP	0.0038	0.0367	0.0522
Trypanosoma cruzi	DNA polymerase beta thumb, putative	0.0042	0.0437	0.0607
Echinococcus granulosus	histone lysine methyltransferase setb	0.0061	0.0833	0.0833
Leishmania major	mitochondrial DNA polymerase beta-PAK, putative	0.014	0.2458	0.4291
Entamoeba histolytica	hypothetical protein	0.0023	0.0053	0.1319
Trypanosoma brucei	serine peptidase, clan SC, family S9A-like protein	0.0063	0.0876	0.1468
Onchocerca volvulus		0.0483	0.9511	1
Schistosoma mansoni	aldehyde dehydrogenase	0.0184	0.3373	0.4594
Echinococcus multilocularis	muscleblind protein	0.0172	0.313	0.313
Brugia malayi	Muscleblind-like protein	0.0172	0.313	0.313
Loa Loa (eye worm)	hypothetical protein	0.0506	1	1
Toxoplasma gondii	aldehyde dehydrogenase	0.0184	0.3373	1
Mycobacterium tuberculosis	Probable peptidase	0.0063	0.0876	0.1812
Loa Loa (eye worm)	hypothetical protein	0.025	0.4717	0.4717
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0367	0.0367
Brugia malayi	follicle stimulating hormone receptor	0.0231	0.4333	0.4333
Leishmania major	oligopeptidase B-like protein,serine peptidase, clan SC, family S9A-like protein	0.0063	0.0876	0.1468
Mycobacterium leprae	Probable lipase LipE	0.0038	0.0367	0.3818
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0156	0.2783	0.6009
Onchocerca volvulus		0.0081	0.1255	0.0971
Toxoplasma gondii	prolyl endopeptidase	0.0158	0.2835	0.8381
Mycobacterium ulcerans	lipase LipD	0.0038	0.0367	0.0522
Mycobacterium leprae	PROBABLE PROTEASE II PTRBB (OLIGOPEPTIDASE B)	0.0063	0.0876	1
Brugia malayi	beta-lactamase family protein	0.0038	0.0367	0.0367
Trypanosoma cruzi	mitochondrial DNA polymerase beta, putative	0.0295	0.5659	1
Mycobacterium ulcerans	glutaminase	0.0316	0.6075	1
Loa Loa (eye worm)	beta-lactamase	0.0038	0.0367	0.0367
Echinococcus granulosus	geminin	0.0377	0.7341	0.7341
Brugia malayi	hypothetical protein	0.025	0.4717	0.4717
Mycobacterium tuberculosis	Conserved protein	0.0038	0.0367	0.0692
Trypanosoma brucei	oligopeptidase b	0.0063	0.0876	0.1468
Onchocerca volvulus	Huntingtin homolog	0.025	0.4717	0.4758
Echinococcus granulosus	prolyl endopeptidase	0.0158	0.2835	0.2835
Plasmodium vivax	hypothetical protein, conserved	0.0038	0.0367	0.4025
Echinococcus granulosus	beta LACTamase domain containing family member	0.0038	0.0367	0.0367
Toxoplasma gondii	LsmAD domain-containing protein	0.0025	0.0099	0.014
Trypanosoma brucei	DNA polymerase beta thumb, putative	0.0042	0.0437	0.0685
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0367	0.0367
Entamoeba histolytica	hypothetical protein	0.004	0.0399	1
Plasmodium vivax	ataxin-2 like protein, putative	0.0025	0.0099	0.0596
Leishmania major	hypothetical protein, conserved	0.0038	0.0367	0.0561
Trichomonas vaginalis	penicillin-binding protein, putative	0.0038	0.0367	0.0386
Brugia malayi	Pre-SET motif family protein	0.0424	0.8306	0.8306
Trypanosoma cruzi	hypothetical protein, conserved	0.0038	0.0367	0.0482
Entamoeba histolytica	hypothetical protein	0.004	0.0399	1
Brugia malayi	prolyl oligopeptidase family protein	0.0158	0.2835	0.2835
Mycobacterium tuberculosis	Probable protease II PtrBa [first part] (oligopeptidase B)	0.0142	0.2494	0.5374
Trypanosoma brucei	mitochondrial DNA polymerase beta-PAK	0.014	0.2458	0.4291
Onchocerca volvulus		0.0103	0.1707	0.1466
Entamoeba histolytica	hypothetical protein	0.004	0.0399	1
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0364	0.0364
Loa Loa (eye worm)	hypothetical protein	0.0172	0.313	0.313
Loa Loa (eye worm)	glutaminase 2	0.0316	0.6075	0.6075
Trichomonas vaginalis	penicillin-binding protein, putative	0.0038	0.0367	0.0386
Echinococcus multilocularis	muscleblind protein 1	0.0172	0.313	0.313
Leishmania major	mitochondrial DNA polymerase beta	0.0295	0.5659	1
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.0103	0.1707	0.1707
Schistosoma mansoni	hypothetical protein	0.0103	0.1707	0.2325
Trypanosoma brucei	mitochondrial DNA polymerase beta	0.0295	0.5659	1
Mycobacterium tuberculosis	Probable hydrolase	0.0038	0.0367	0.0692
Loa Loa (eye worm)	hypothetical protein	0.0172	0.313	0.313
Trypanosoma cruzi	mitochondrial DNA polymerase beta, putative	0.0295	0.5659	1
Schistosoma mansoni	aldehyde dehydrogenase	0.0184	0.3373	0.4594
Schistosoma mansoni	survival motor neuron protein	0.0103	0.1707	0.2325
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0038	0.0367	0.0367
Echinococcus granulosus	survival motor neuron protein 1	0.0506	1	1
Schistosoma mansoni	prolyl oligopeptidase (S09 family)	0.0158	0.2835	0.3862
Echinococcus granulosus	L aminoadipate semialdehyde	0.0081	0.1255	0.1255
Toxoplasma gondii	hypothetical protein	0.0048	0.0562	0.1535
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0367	0.0367
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0231	0.4333	0.4333
Trypanosoma cruzi	mitochondrial DNA polymerase beta-PAK, putative	0.0042	0.0437	0.0607
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0095	0.1541	0.1541
Treponema pallidum	4'-phosphopantetheinyl transferase	0.0023	0.0053	0.5
Brugia malayi	Pre-SET motif family protein	0.0061	0.0833	0.0833
Echinococcus granulosus	muscleblind protein	0.0172	0.313	0.313
Mycobacterium ulcerans	beta-lactamase	0.0038	0.0367	0.0522
Entamoeba histolytica	hypothetical protein	0.004	0.0399	1
Mycobacterium leprae	conserved hypothetical protein	0.0038	0.0367	0.3818
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0095	0.1541	0.1541
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0095	0.1541	0.21
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0184	0.3373	0.5513
Brugia malayi	hypothetical protein	0.004	0.0399	0.0399
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0833	0.0833

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 2.3 nM	inhibition of rat cortex POP	ChEMBL.	20058865

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: CHEMBL1087607

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1126421