TDR Targets

Basic information

Technical information

TDR Targets ID: 1445043
Name: 2-(1-adamantyl)-N-(1-ethyl-3,5-dimethylpyrazo l-4-yl)acetamide
MW: 315.453 | Formula: C19H29N3O
H donors: 1 H acceptors: 2 LogP: 3.9 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: CCn1nc(c(c1C)NC(=O)CC12CC3CC(C2)CC(C1)C3)C
InChi: 1S/C19H29N3O/c1-4-22-13(3)18(12(2)21-22)20-17(23)11-19-8-14-5-15(9-19)7-16(6-14)10-19/h14-16H,4-11H2,1-3H3,(H,20,23)
InChiKey: LJNVAMCVDXOACC-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-(1-adamantyl)-N-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)acetamide
2-(1-adamantyl)-N-(1-ethyl-3,5-dimethyl-4-pyrazolyl)acetamide
2-(1-adamantyl)-N-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)ethanamide
2-(1-adamantyl)-N-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)acetamide
MLS000698201
SMR000227900
ZINC05954441
STK331646

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Mus musculus	RAR-related orphan receptor gamma	Starlite/ChEMBL	No references
Homo sapiens	lamin A/C	Starlite/ChEMBL	No references
Homo sapiens	geminin, DNA replication inhibitor	Starlite/ChEMBL	No references
Homo sapiens	survival of motor neuron 2, centromeric	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Echinococcus multilocularis	musashi	Get druggable targets OG5_128723	All targets in OG5_128723
Schistosoma mansoni	intermediate filament proteins	Get druggable targets OG5_128723	All targets in OG5_128723
Echinococcus multilocularis	lamin	Get druggable targets OG5_128723	All targets in OG5_128723
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_128723	All targets in OG5_128723
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_128723	All targets in OG5_128723
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	Get druggable targets OG5_128723	All targets in OG5_128723
Onchocerca volvulus		Get druggable targets OG5_128723	All targets in OG5_128723
Echinococcus granulosus	intermediate filament protein	Get druggable targets OG5_128723	All targets in OG5_128723
Schistosoma mansoni	lamin	Get druggable targets OG5_128723	All targets in OG5_128723
Echinococcus granulosus	cytoplasmic intermediate filament protein	Get druggable targets OG5_128723	All targets in OG5_128723
Brugia malayi	Intermediate filament tail domain containing protein	Get druggable targets OG5_128723	All targets in OG5_128723
Echinococcus multilocularis	survival motor neuron protein 1	Get druggable targets OG5_132873	All targets in OG5_132873
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_128723	All targets in OG5_128723
Echinococcus multilocularis	cytoplasmic intermediate filament protein	Get druggable targets OG5_128723	All targets in OG5_128723
Brugia malayi	intermediate filament protein	Get druggable targets OG5_128723	All targets in OG5_128723
Schistosoma japonicum	expressed protein	Get druggable targets OG5_128723	All targets in OG5_128723
Schistosoma japonicum	ko:K07611 lamin, putative	Get druggable targets OG5_128723	All targets in OG5_128723
Brugia malayi	hypothetical protein	Get druggable targets OG5_132873	All targets in OG5_132873
Onchocerca volvulus		Get druggable targets OG5_128723	All targets in OG5_128723
Echinococcus granulosus	survival motor neuron protein 1	Get druggable targets OG5_132873	All targets in OG5_132873
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_128723	All targets in OG5_128723
Schistosoma japonicum	Lamin-C, putative	Get druggable targets OG5_128723	All targets in OG5_128723
Echinococcus granulosus	lamin dm0	Get druggable targets OG5_128723	All targets in OG5_128723
Echinococcus granulosus	lamin	Get druggable targets OG5_128723	All targets in OG5_128723
Schistosoma japonicum	Intermediate filament protein ifa-1, putative	Get druggable targets OG5_128723	All targets in OG5_128723
Loa Loa (eye worm)	intermediate filament protein	Get druggable targets OG5_128723	All targets in OG5_128723
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_128723	All targets in OG5_128723
Echinococcus multilocularis	lamin dm0	Get druggable targets OG5_128723	All targets in OG5_128723
Schistosoma japonicum	expressed protein	Get druggable targets OG5_128723	All targets in OG5_128723
Schistosoma mansoni	lamin	Get druggable targets OG5_128723	All targets in OG5_128723
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_132873	All targets in OG5_132873

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Brugia malayi	Hypothetical 65.5 kDa Trp-Asp repeats containing protein F02E8.5 inchromosome X	geminin, DNA replication inhibitor	209 aa	176 aa	27.8 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Brugia malayi	Latrophilin receptor protein 2	0.0079	0.2215	0.2314
Wolbachia endosymbiont of Brugia malayi	ATP-dependent Clp protease proteolytic subunit	0.0084	0.237	1
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0036	0.0678	0.0759
Mycobacterium leprae	Probable lipase LipE	0.0036	0.0678	0.1167
Onchocerca volvulus		0.0048	0.1101	0.6115
Chlamydia trachomatis	ATP-dependent Clp protease proteolytic subunit	0.0084	0.237	0.5
Trypanosoma brucei	trypanothione reductase	0.0037	0.0695	0.4781
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0091	0.261	0.2647
Mycobacterium tuberculosis	Probable lipase LipE	0.0036	0.0678	0.0759
Loa Loa (eye worm)	glutathione reductase	0.0037	0.0695	0.0726
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0125	0.3854	0.4026
Mycobacterium leprae	conserved hypothetical protein	0.0036	0.0678	0.1167
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0033	0.054	0.0564
Brugia malayi	hypothetical protein	0.0286	0.9572	1
Echinococcus granulosus	thioredoxin glutathione reductase	0.0037	0.0713	0.0645
Schistosoma mansoni	myelin transcription factor 1 myt1	0.0055	0.1339	0.1249
Trichomonas vaginalis	D-aminoacylase, putative	0.0036	0.0678	0.464
Schistosoma mansoni	peptidase Clp (S14 family)	0.0084	0.237	0.2291
Trichomonas vaginalis	CMGC family protein kinase	0.0055	0.1343	1
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0251	0.8346	0.8719
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0094	0.272	1
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0036	0.0678	0.0608
Loa Loa (eye worm)	intermediate filament protein	0.0033	0.054	0.0564
Echinococcus multilocularis	ATP dependent Clp protease proteolytic subunit	0.0084	0.237	0.2394
Trichomonas vaginalis	CMGC family protein kinase	0.0055	0.1343	1
Plasmodium falciparum	glutathione reductase	0.0037	0.0695	0.2615
Mycobacterium leprae	PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2)	0.0084	0.237	0.8486
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0678	0.0708
Echinococcus granulosus	geminin	0.0205	0.6683	0.6949
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0036	0.0677	0.0607
Plasmodium vivax	hypothetical protein, conserved	0.0036	0.0678	0.2538
Trypanosoma brucei	protein kinase, putative	0.0055	0.1343	1
Trichomonas vaginalis	CMGC family protein kinase	0.0055	0.1343	1
Onchocerca volvulus		0.0036	0.0678	0.1507
Brugia malayi	C2-HC type zinc finger protein C.e-MyT1	0.0055	0.1339	0.1399
Trypanosoma cruzi	mitogen activated protein kinase 2, putative	0.0055	0.1343	1
Echinococcus granulosus	endonuclease exonuclease phosphatase	0.0194	0.6315	0.656
Toxoplasma gondii	ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein	0.0084	0.237	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0091	0.261	0.2533
Loa Loa (eye worm)	CMGC/MAPK/ERK1 protein kinase	0.0055	0.1343	0.1403
Echinococcus granulosus	ATP dependent Clp protease proteolytic subunit	0.0084	0.237	0.2394
Echinococcus multilocularis	polycomb protein SCMH1	0.0048	0.1101	0.1054
Mycobacterium tuberculosis	Probable reductase	0.0084	0.2384	0.3008
Plasmodium vivax	ATP-dependent Clp protease proteolytic subunit, putative	0.0084	0.237	1
Onchocerca volvulus	Polycomb protein Sfmbt homolog	0.0048	0.1101	0.6115
Trypanosoma cruzi	hypothetical protein, conserved	0.0036	0.0678	0.464
Loa Loa (eye worm)	TAR-binding protein	0.0125	0.3854	0.4026
Echinococcus granulosus	survival motor neuron protein 1	0.0286	0.9572	1
Brugia malayi	beta-lactamase family protein	0.0036	0.0678	0.0708
Schistosoma mansoni	tar DNA-binding protein	0.0125	0.3854	0.379
Echinococcus granulosus	mitogen activated protein kinase	0.0055	0.1343	0.1309
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0233	0.7688	1
Schistosoma mansoni	hypothetical protein	0.0172	0.5508	0.5462
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0678	0.0708
Schistosoma mansoni	hypothetical protein	0.0205	0.6683	0.6648
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0678	0.0708
Mycobacterium ulcerans	beta-lactamase	0.0036	0.0678	0.2538
Trichomonas vaginalis	penicillin-binding protein, putative	0.0036	0.0678	0.464
Plasmodium vivax	ATP-dependent Clp protease proteolytic subunit, putative	0.0029	0.0408	0.1348
Echinococcus multilocularis	GPCR, family 2	0.0079	0.2215	0.2231
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0251	0.8346	0.8719
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0036	0.0678	0.0759
Brugia malayi	Probable ClpP-like protease	0.0084	0.237	0.2476
Schistosoma mansoni	hypothetical protein	0.0079	0.2215	0.2134
Brugia malayi	MAP kinase sur-1	0.0055	0.1343	0.1403
Schistosoma mansoni	hypothetical protein	0.0036	0.0677	0.058
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.0058	0.1457	0.1522
Mycobacterium tuberculosis	Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2)	0.0055	0.1339	0.163
Trypanosoma cruzi	trypanothione reductase, putative	0.0037	0.0695	0.4781
Schistosoma mansoni	tar DNA-binding protein	0.0125	0.3854	0.379
Brugia malayi	latrophilin 2 splice variant baaae	0.0172	0.5508	0.5754
Schistosoma mansoni	survival motor neuron protein	0.0058	0.1457	0.1368
Brugia malayi	mbt repeat family protein	0.0048	0.1101	0.115
Echinococcus multilocularis	mitogen activated protein kinase	0.0055	0.1343	0.1309
Loa Loa (eye worm)	hypothetical protein	0.0084	0.237	0.2476
Mycobacterium tuberculosis	Conserved protein	0.0036	0.0678	0.0759
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0234	0.7745	0.8091
Mycobacterium tuberculosis	Conserved protein	0.0036	0.0678	0.0759
Loa Loa (eye worm)	hypothetical protein	0.0172	0.5508	0.5754
Trichomonas vaginalis	esterase, putative	0.0036	0.0678	0.464
Entamoeba histolytica	hypothetical protein	0.0036	0.0677	1
Mycobacterium ulcerans	lipase LipD	0.0036	0.0678	0.2538
Schistosoma mansoni	tar DNA-binding protein	0.0125	0.3854	0.379
Onchocerca volvulus		0.0036	0.0678	0.1507
Schistosoma mansoni	sex comb on midleg homolog	0.0048	0.1101	0.1008
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0079	0.2215	0.2314
Echinococcus granulosus	peptidase Clp S14 family	0.0055	0.1339	0.1305
Brugia malayi	intermediate filament protein	0.0033	0.054	0.0564
Trichomonas vaginalis	CMGC family protein kinase	0.0055	0.1343	1
Mycobacterium ulcerans	ATP-dependent Clp protease proteolytic subunit	0.0084	0.237	1
Schistosoma mansoni	lamin	0.0033	0.054	0.0442
Brugia malayi	beta-lactamase family protein	0.0036	0.0678	0.0708
Mycobacterium tuberculosis	Probable NADH dehydrogenase Ndh	0.0084	0.2384	0.3008
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0036	0.0678	0.0708
Schistosoma mansoni	lamin	0.0033	0.054	0.0442
Mycobacterium tuberculosis	Probable hydrolase	0.0036	0.0678	0.0759
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0037	0.0713	0.0645
Entamoeba histolytica	hypothetical protein	0.0036	0.0677	1
Mycobacterium tuberculosis	Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB	0.0084	0.2384	0.3008
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0091	0.261	0.2726
Mycobacterium ulcerans	hypothetical protein	0.0036	0.0678	0.2538
Echinococcus multilocularis	lamin dm0	0.0033	0.054	0.0462
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0091	0.261	0.2533
Loa Loa (eye worm)	mbt repeat family protein	0.0048	0.1101	0.115
Mycobacterium tuberculosis	Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP)	0.0055	0.1339	0.163
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0678	0.0708
Trypanosoma cruzi	mitogen-activated protein kinase 11, putative	0.0055	0.1343	1
Mycobacterium tuberculosis	Probable membrane NADH dehydrogenase NdhA	0.0084	0.2384	0.3008
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0251	0.8346	0.8719
Brugia malayi	RNA recognition motif domain containing protein	0.0125	0.3854	0.4026
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0519	0.0542
Plasmodium vivax	thioredoxin reductase, putative	0.0037	0.0695	0.2615
Echinococcus granulosus	lamin dm0	0.0033	0.054	0.0462
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0036	0.0678	0.2538
Echinococcus multilocularis	survival motor neuron protein 1	0.0286	0.9572	1
Mycobacterium tuberculosis	Probable oxidoreductase	0.0094	0.272	0.345
Schistosoma mansoni	tar DNA-binding protein	0.0125	0.3854	0.379
Mycobacterium ulcerans	ATP-dependent Clp protease proteolytic subunit	0.0084	0.237	1
Schistosoma mansoni	intermediate filament proteins	0.0033	0.054	0.0442
Brugia malayi	beta-lactamase	0.0036	0.0678	0.0708
Treponema pallidum	ATP-dependent Clp protease proteolytic subunit	0.0084	0.237	1
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0036	0.0677	0.0607
Giardia lamblia	Kinase, CMGC MAPK	0.0055	0.1343	1
Toxoplasma gondii	ABC1 family protein	0.0036	0.0678	0.2538
Echinococcus multilocularis	endonuclease exonuclease phosphatase	0.0194	0.6315	0.656
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0091	0.261	0.2726
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0079	0.2215	0.2231
Chlamydia trachomatis	ATP-dependent Clp protease proteolytic subunit	0.0084	0.237	0.5
Toxoplasma gondii	CMGC kinase, MAPK family (ERK) MAPK-1	0.0055	0.1343	0.547
Echinococcus granulosus	histone acetyltransferase MYST2	0.0055	0.1339	0.1306
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0678	0.0708
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0036	0.0678	0.0708
Schistosoma mansoni	hypothetical protein	0.0079	0.2215	0.2134
Schistosoma mansoni	hypothetical protein	0.0205	0.6683	0.6648
Schistosoma mansoni	hypothetical protein	0.0079	0.2215	0.2134
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0079	0.2215	0.2231
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0079	0.2215	0.2231
Loa Loa (eye worm)	MBCTL1	0.0055	0.1339	0.1399
Mycobacterium leprae	PROBABLE NADH DEHYDROGENASE NDH	0.0084	0.2384	0.8548
Echinococcus granulosus	intermediate filament protein	0.0033	0.054	0.0462
Schistosoma mansoni	serine/threonine protein kinase	0.0055	0.1343	0.1253
Echinococcus granulosus	SAM and MBT domain containing protein	0.0048	0.1101	0.1054
Mycobacterium tuberculosis	Putative ferredoxin reductase	0.0084	0.2384	0.3008
Loa Loa (eye worm)	beta-lactamase	0.0036	0.0678	0.0708
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.0094	0.272	0.345
Leishmania major	mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440	0.0055	0.1343	1
Schistosoma mansoni	sex comb on midleg homolog	0.0048	0.1101	0.1008
Onchocerca volvulus		0.0036	0.0678	0.1507
Loa Loa (eye worm)	hypothetical protein	0.0079	0.2215	0.2314
Loa Loa (eye worm)	hypothetical protein	0.0048	0.1101	0.115
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0091	0.261	0.2647
Trypanosoma brucei	hypothetical protein, conserved	0.0036	0.0678	0.464
Echinococcus granulosus	lamin	0.0033	0.054	0.0462
Mycobacterium tuberculosis	Conserved protein	0.0036	0.0678	0.0759
Echinococcus granulosus	tar DNA binding protein	0.0125	0.3854	0.3961
Entamoeba histolytica	hypothetical protein	0.0036	0.0677	1
Echinococcus granulosus	GPCR family 2	0.0079	0.2215	0.2231
Mycobacterium tuberculosis	NADPH-dependent mycothiol reductase Mtr	0.0037	0.0695	0.0782
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0091	0.261	0.2647
Echinococcus granulosus	beta LACTamase domain containing family member	0.0036	0.0678	0.0608
Brugia malayi	mbt repeat family protein	0.0048	0.1101	0.115
Plasmodium vivax	glutathione reductase, putative	0.0037	0.0695	0.2615
Brugia malayi	follicle stimulating hormone receptor	0.0234	0.7745	0.8091
Mycobacterium tuberculosis	Probable lipase LipD	0.0036	0.0678	0.0759
Brugia malayi	exodeoxyribonuclease III family protein	0.002	0.0103	0.0107
Echinococcus granulosus	mitogen activated protein kinase 3	0.0055	0.1343	0.1309
Plasmodium falciparum	ATP-dependent Clp protease proteolytic subunit	0.0084	0.237	1
Schistosoma mansoni	scm-relatedprotein containing 4 mbt domains (sfmbt)	0.0048	0.1101	0.1008
Echinococcus multilocularis	lamin	0.0033	0.054	0.0462
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0091	0.261	0.2647
Loa Loa (eye worm)	hypothetical protein	0.0055	0.1339	0.1399
Loa Loa (eye worm)	hypothetical protein	0.0033	0.054	0.0564
Brugia malayi	RNA binding protein	0.0125	0.3854	0.4026
Echinococcus multilocularis	histone acetyltransferase MYST2	0.0055	0.1339	0.1306
Leishmania major	trypanothione reductase	0.0037	0.0695	0.4781
Brugia malayi	Thioredoxin reductase	0.0037	0.0695	0.0726
Schistosoma mansoni	tar DNA-binding protein	0.0125	0.3854	0.379
Echinococcus multilocularis	peptidase Clp (S14 family)	0.0055	0.1339	0.1305
Mycobacterium tuberculosis	Probable dehydrogenase	0.0084	0.2384	0.3008
Loa Loa (eye worm)	thioredoxin reductase	0.0037	0.0695	0.0726
Schistosoma mansoni	transcription factor LCR-F1	0.0036	0.0677	0.058
Trypanosoma cruzi	hypothetical protein, conserved	0.0036	0.0678	0.464
Loa Loa (eye worm)	RNA binding protein	0.0125	0.3854	0.4026
Onchocerca volvulus		0.0058	0.1457	1
Echinococcus multilocularis	SAM and MBT domain containing protein	0.0048	0.1101	0.1054
Plasmodium falciparum	thioredoxin reductase	0.0037	0.0695	0.2615
Schistosoma mansoni	hypothetical protein	0.0079	0.2215	0.2134
Brugia malayi	glutathione reductase	0.0037	0.0695	0.0726
Brugia malayi	hypothetical protein	0.0036	0.0677	0.0707
Trichomonas vaginalis	D-aminoacylase, putative	0.0036	0.0678	0.464
Mycobacterium tuberculosis	Probable esterase LipL	0.0036	0.0678	0.0759
Plasmodium falciparum	ATP-dependent Clp protease proteolytic subunit	0.0029	0.0408	0.1348
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0036	0.0678	0.0581
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.002	0.0103	0.0107
Trichomonas vaginalis	D-aminoacylase, putative	0.0036	0.0678	0.464
Trichomonas vaginalis	penicillin-binding protein, putative	0.0036	0.0678	0.464
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0678	0.0708
Toxoplasma gondii	hypothetical protein	0.0029	0.0408	0.1348
Brugia malayi	TAR-binding protein	0.0125	0.3854	0.4026
Loa Loa (eye worm)	hypothetical protein	0.0251	0.8346	0.8719
Echinococcus multilocularis	mitogen activated protein kinase 3	0.0055	0.1343	0.1309
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0079	0.2215	0.2231
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0036	0.0678	0.0581
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0036	0.0678	0.0759
Leishmania major	mitogen activated protein kinase, putative,map kinase, putative	0.0055	0.1343	1
Trypanosoma cruzi	mitogen-activated protein kinase 11, putative	0.0055	0.1343	1
Echinococcus multilocularis	suppression of tumorigenicity 18 protein	0.0055	0.1339	0.1306
Trypanosoma brucei	mitogen activated protein kinase 4, putative	0.0055	0.1343	1
Mycobacterium leprae	PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP)	0.0055	0.1339	0.4025
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.0094	0.272	0.345
Brugia malayi	Intermediate filament tail domain containing protein	0.0033	0.054	0.0564
Toxoplasma gondii	thioredoxin reductase	0.0037	0.0695	0.2615
Schistosoma mansoni	hypothetical protein	0.0058	0.1457	0.1368
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0091	0.261	0.2533
Echinococcus multilocularis	musashi	0.0033	0.054	0.0462
Echinococcus multilocularis	tar DNA binding protein	0.0125	0.3854	0.3961
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0079	0.2215	0.2314
Loa Loa (eye worm)	hypothetical protein	0.0286	0.9572	1
Echinococcus multilocularis	geminin	0.0205	0.6683	0.6949
Trypanosoma cruzi	mitogen activated protein kinase 4, putative	0.0055	0.1343	1
Echinococcus granulosus	suppression of tumorigenicity 18 protein	0.0055	0.1339	0.1306
Treponema pallidum	ATP-dependent Clp protease proteolytic subunit	0.0029	0.0408	0.1348
Leishmania major	hypothetical protein, conserved	0.0036	0.0678	0.464
Mycobacterium ulcerans	esterase/lipase LipP	0.0036	0.0678	0.2538
Toxoplasma gondii	ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein	0.0084	0.237	1
Entamoeba histolytica	hypothetical protein	0.0036	0.0677	1
Echinococcus granulosus	polycomb protein SCMH1	0.0048	0.1101	0.1054

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	5.6234 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of binding or entry into cells for Lassa Virus. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID463114, AID540249]	ChEMBL.	No reference
Potency (functional)	= 7.9433 um	PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	8.2753 uM	PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850]	ChEMBL.	No reference
Potency (functional)	16.3601 uM	PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in MCF 10a normal breast cells. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	= 17.7828 um	PUBCHEM_BIOASSAY: qHTS Assay for Modulators of Lamin A Splicing. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	= 19.9526 um	PUBCHEM_BIOASSAY: qHTS Assay for Enhancers of SMN2 Splice Variant Expression. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	= 31.6228 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 (binding)	125.8925 uM	PubChem BioAssay. qHTS Assay for Inhibitors of MBNL1-poly(CUG) RNA binding. (Class of assay: confirmatory)	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Plasmodium falciparum	ChEMBL23
Homo sapiens	ChEMBL23

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?

In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.

In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

ChEMBL: CHEMBL1596216

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1445043