TDR Targets

Basic information

Technical information

TDR Targets ID: 1340076
Name: (4-fluorophenyl)-[1-methyl-4-(4-methylphenyl) pyrrolidin-3-yl]methanone
MW: 297.367 | Formula: C19H20FNO
H donors: 0 H acceptors: 1 LogP: 3.6 Rotable bonds: 3
Rule of 5 violations (Lipinski): 1
SMILES: CN1CC(C(C1)C(=O)c1ccc(cc1)F)c1ccc(cc1)C
InChi: 1S/C19H20FNO/c1-13-3-5-14(6-4-13)17-11-21(2)12-18(17)19(22)15-7-9-16(20)10-8-15/h3-10,17-18H,11-12H2,1-2H3
InChiKey: BYKGNHGDMQKYEE-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

(4-fluorophenyl)-[1-methyl-4-(4-methylphenyl)-3-pyrrolidinyl]methanone
4N-726
Oprea1_244727

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	glucagon-like peptide 1 receptor	Starlite/ChEMBL	No references
Homo sapiens	GNAS complex locus	Starlite/ChEMBL	No references
Influenza A virus	Nonstructural protein 1	Starlite/ChEMBL	No references
Mus musculus	transient receptor potential cation channel, subfamily C, member 4	Starlite/ChEMBL	No references
Homo sapiens	glycoprotein hormones, alpha polypeptide	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus multilocularis	transient receptor potential ion channel A	Get druggable targets OG5_128782	All targets in OG5_128782
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Brugia malayi	Transient-receptor-potential like protein	Get druggable targets OG5_128782	All targets in OG5_128782
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_128782	All targets in OG5_128782
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma japonicum	Short transient receptor potential channel 5, putative	Get druggable targets OG5_128782	All targets in OG5_128782
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus granulosus	TRP transient receptor potential channel	Get druggable targets OG5_128782	All targets in OG5_128782
Schistosoma mansoni	transient receptor potential channel	Get druggable targets OG5_128782	All targets in OG5_128782
Schistosoma japonicum	ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus multilocularis	transient receptor potential gamma protein	Get druggable targets OG5_128782	All targets in OG5_128782
Echinococcus granulosus	transient receptor potential gamma protein	Get druggable targets OG5_128782	All targets in OG5_128782
Schistosoma japonicum	Transient receptor potential-gamma protein, putative	Get druggable targets OG5_128782	All targets in OG5_128782
Schistosoma mansoni	transient receptor potential channel 4	Get druggable targets OG5_128782	All targets in OG5_128782
Echinococcus granulosus	transient receptor potential ion channel A	Get druggable targets OG5_128782	All targets in OG5_128782
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma japonicum	ko:K05328 transient receptor potential cation channel, subfamily C,, putative	Get druggable targets OG5_128782	All targets in OG5_128782
Schistosoma japonicum	ko:K05328 transient receptor potential cation channel, subfamily C,, putative	Get druggable targets OG5_128782	All targets in OG5_128782
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	Get druggable targets OG5_131088	All targets in OG5_131088
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_128782	All targets in OG5_128782
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_128782	All targets in OG5_128782
Echinococcus multilocularis	TRP (transient receptor potential) channel	Get druggable targets OG5_128782	All targets in OG5_128782
Schistosoma japonicum	Short transient receptor potential channel 5, putative	Get druggable targets OG5_128782	All targets in OG5_128782

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Echinococcus multilocularis	short transient receptor potential channel 6	transient receptor potential cation channel, subfamily C, member 4	890 aa	799 aa	31.2 %
Schistosoma mansoni	GTP-binding protein alpha subunit gna	GNAS complex locus	394 aa	450 aa	28.7 %
Mycobacterium tuberculosis	Hypothetical protein	Nonstructural protein 1	230 aa	202 aa	23.8 %
Toxoplasma gondii	intraflagellar transport protein 172, putative	glycoprotein hormones, alpha polypeptide	116 aa	94 aa	26.6 %
Loa Loa (eye worm)	pigment dispersing factor receptor c	glucagon-like peptide 1 receptor	463 aa	388 aa	25.8 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus multilocularis	sentrin specific protease 1	0.004	0.1042	0.1357
Schistosoma mansoni	family C48 unassigned peptidase (C48 family)	0.004	0.1042	0.1357
Loa Loa (eye worm)	hypothetical protein	0.004	0.1042	0.12
Wolbachia endosymbiont of Brugia malayi	exonuclease III	0.0018	0	0.5
Toxoplasma gondii	ICE family protease (caspase) p20 domain-containing protein	0.0028	0.0443	0.4256
Echinococcus multilocularis	caspase 8	0.0028	0.0443	0.0578
Loa Loa (eye worm)	hypothetical protein	0.0117	0.4685	0.5397
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0023	0.0225	0.5718
Leishmania major	metacaspase, putative	0.0028	0.0443	0.4256
Mycobacterium tuberculosis	Carboxylesterase LipT	0.0027	0.0393	1
Brugia malayi	latrophilin 2 splice variant baaae	0.0041	0.1085	0.125
Schistosoma mansoni	subfamily C14A unassigned peptidase (C14 family)	0.0028	0.0443	0.0578
Echinococcus granulosus	acetylcholinesterase	0.0157	0.6568	0.8559
Echinococcus granulosus	transient receptor potential ion channel A	0.0113	0.45	0.5864
Echinococcus granulosus	acetylcholinesterase	0.0157	0.6568	0.8559
Brugia malayi	Carboxylesterase family protein	0.0027	0.0393	0.0453
Onchocerca volvulus		0.0027	0.0393	0.0172
Trichomonas vaginalis	conserved hypothetical protein	0.0028	0.0443	0.0443
Schistosoma mansoni	hypothetical protein	0.0041	0.1085	0.1414
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0023	0.0225	0.5
Echinococcus granulosus	sentrin specific protease 7	0.018	0.7674	1
Echinococcus multilocularis	family S9 non peptidase ue (S09 family)	0.0027	0.0393	0.0512
Echinococcus granulosus	short transient receptor potential channel 6	0.0078	0.2807	0.3658
Brugia malayi	Carboxylesterase family protein	0.0027	0.0393	0.0453
Trypanosoma cruzi	metacaspase, putative	0.0028	0.0443	0.1207
Trypanosoma brucei	metacaspase 5, putative	0.0028	0.0443	0.4256
Plasmodium falciparum	metacaspase 1	0.0028	0.0443	0.4256
Toxoplasma gondii	Ulp1 protease family, C-terminal catalytic domain-containing protein	0.004	0.1042	1
Toxoplasma gondii	ICE family protease (caspase) p20 domain-containing protein	0.0028	0.0443	0.4256
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.1752	0.2283
Plasmodium vivax	metacaspase 1, putative	0.0028	0.0443	0.4256
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0202	0.8681	1
Trichomonas vaginalis	Clan CD, family C14, metacaspase-like cysteine peptidase	0.0028	0.0443	0.0443
Echinococcus granulosus	histone lysine methyltransferase setb	0.0029	0.0506	0.066
Echinococcus multilocularis	caspase 3, apoptosis cysteine peptidase	0.0103	0.4021	0.524
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0029	0.0506	0.066
Trichomonas vaginalis	Clan CE, family C48, Ulp1-like cysteine peptidase	0.0096	0.3674	0.3674
Brugia malayi	AMP-binding enzyme family protein	0.0023	0.0225	0.0259
Onchocerca volvulus		0.004	0.1042	0.0836
Echinococcus granulosus	para nitrobenzyl esterase	0.0027	0.0393	0.0512
Trichomonas vaginalis	Clan CE, family C48, Ulp1-like cysteine peptidase	0.004	0.1042	0.1042
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0029	0.0506	0.066
Trichomonas vaginalis	Clan CE, family C48, Ulp1-like cysteine peptidase	0.004	0.1042	0.1042
Toxoplasma gondii	Ulp1 protease family, C-terminal catalytic domain-containing protein	0.004	0.1042	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.1752	0.2283
Echinococcus multilocularis	transient receptor potential ion channel A	0.0113	0.45	0.5864
Schistosoma mansoni	transcription factor LCR-F1	0.0037	0.0908	0.1183
Onchocerca volvulus		0.0029	0.0506	0.0288
Brugia malayi	Ulp1 protease family, C-terminal catalytic domain containing protein	0.004	0.1042	0.12
Schistosoma mansoni	hypothetical protein	0.0019	0.0039	0.0051
Echinococcus granulosus	caspase 8	0.0028	0.0443	0.0578
Plasmodium vivax	SET domain protein, putative	0.0029	0.0506	0.4862
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0055	0.1752	0.2018
Echinococcus multilocularis	TRP (transient receptor potential) channel	0.0044	0.1201	0.1565
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0023	0.0225	0.0293
Schistosoma mansoni	caspase-7 (C14 family)	0.0028	0.0443	0.0578
Schistosoma mansoni	transient receptor potential channel	0.0117	0.4685	0.6105
Brugia malayi	Latrophilin receptor protein 2	0.0019	0.0039	0.0045
Echinococcus granulosus	BC026374 protein S09 family	0.0027	0.0393	0.0512
Brugia malayi	hypothetical protein	0.0037	0.0908	0.1045
Trypanosoma cruzi	metacaspase 5, putative	0.0028	0.0443	0.1207
Echinococcus granulosus	caspase 3 apoptosis cysteine peptidase	0.0103	0.4021	0.524
Brugia malayi	hypothetical protein	0.0027	0.0393	0.0453
Loa Loa (eye worm)	hypothetical protein	0.004	0.1016	0.117
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0506	0.0583
Trichomonas vaginalis	conserved hypothetical protein	0.0028	0.0443	0.0443
Echinococcus multilocularis	GPCR, family 2	0.0019	0.0039	0.0051
Trichomonas vaginalis	set domain proteins, putative	0.023	1	1
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0019	0.0039	0.0051
Loa Loa (eye worm)	carboxylesterase	0.0027	0.0393	0.0453
Entamoeba histolytica	hypothetical protein	0.0037	0.0908	0.1183
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0023	0.0225	0.5718
Loa Loa (eye worm)	hypothetical protein	0.0157	0.6568	0.7566
Leishmania major	4-coumarate:coa ligase-like protein	0.0023	0.0225	0.2158
Trypanosoma brucei	SUMO1/Ulp2, putative	0.004	0.1042	1
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0037	0.0908	0.1183
Schistosoma mansoni	caspase-3 (C14 family)	0.0103	0.4021	0.524
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0029	0.0506	0.066
Loa Loa (eye worm)	acetylcholinesterase 1	0.0157	0.6568	0.7566
Onchocerca volvulus		0.0027	0.0393	0.0172
Echinococcus granulosus	family S9 non peptidase ue S09 family	0.0027	0.0393	0.0512
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0225	0.0259
Trichomonas vaginalis	Clan CD, family C14, metacaspase-like cysteine peptidase	0.0028	0.0443	0.0443
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0225	0.0259
Brugia malayi	Carboxylesterase family protein	0.0027	0.0393	0.0453
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0157	0.6568	0.8559
Schistosoma mansoni	family C48 unassigned peptidase (C48 family)	0.004	0.1042	0.1357
Trichomonas vaginalis	Clan CD, family C14, metacaspase-like cysteine peptidase	0.0028	0.0443	0.0443
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0393	0.0453
Trypanosoma cruzi	metacaspase 5, putative	0.0028	0.0443	0.1207
Chlamydia trachomatis	deubiquitinase/deneddylase Dub2	0.004	0.1042	0.5
Loa Loa (eye worm)	hypothetical protein	0.0074	0.2622	0.302
Schistosoma mansoni	family C48 unassigned peptidase (C48 family)	0.018	0.7674	1
Echinococcus granulosus	expressed conserved protein	0.014	0.577	0.7519
Schistosoma mansoni	BC026374 protein (S09 family)	0.0027	0.0393	0.0512
Trichomonas vaginalis	Clan CD, family C14, metacaspase-like cysteine peptidase	0.0028	0.0443	0.0443
Schistosoma mansoni	transient receptor potential channel	0.0078	0.2807	0.3658
Trypanosoma cruzi	metacaspase, putative	0.0028	0.0443	0.1207
Trichomonas vaginalis	Clan CE, family C48, Ulp1-like cysteine peptidase	0.004	0.1042	0.1042
Schistosoma mansoni	hypothetical protein	0.0019	0.0039	0.0051
Trypanosoma brucei	metacaspase	0.0028	0.0443	0.4256
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.1752	0.2283
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0027	0.0393	0.0512
Mycobacterium ulcerans	carboxylesterase, LipT	0.0027	0.0393	1
Echinococcus multilocularis	acetylcholinesterase	0.0157	0.6568	0.8559
Loa Loa (eye worm)	hypothetical protein	0.0041	0.1085	0.125
Trypanosoma cruzi	metacaspase, putative	0.0028	0.0443	0.1207
Echinococcus granulosus	transient receptor potential gamma protein	0.0117	0.4685	0.6105
Echinococcus granulosus	neuroligin	0.0027	0.0393	0.0512
Echinococcus multilocularis	short transient receptor potential channel 6	0.0078	0.2807	0.3658
Trypanosoma cruzi	hypothetical protein	0.0096	0.3674	1
Entamoeba histolytica	hypothetical protein	0.0037	0.0908	0.1183
Treponema pallidum	exodeoxyribonuclease (exoA)	0.0018	0	0.5
Loa Loa (eye worm)	carboxylesterase	0.0027	0.0393	0.0453
Echinococcus granulosus	caspase	0.0103	0.4021	0.524
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0029	0.0506	0.066
Echinococcus multilocularis	short transient receptor potential channel 6	0.0078	0.2807	0.3658
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0019	0.0039	0.0045
Echinococcus granulosus	sentrin specific protease 1	0.004	0.1042	0.1357
Schistosoma mansoni	hypothetical protein	0.0019	0.0039	0.0051
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C48, putative	0.004	0.1042	0.2835
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.1752	0.2283
Trichomonas vaginalis	Clan CE, family C48, Ulp1-like cysteine peptidase	0.0096	0.3674	0.3674
Entamoeba histolytica	Ulp1 protease family, C-terminal catalytic domain containing protein	0.018	0.7674	1
Brugia malayi	Carboxylesterase family protein	0.0027	0.0393	0.0453
Entamoeba histolytica	Ulp1 protease family, C-terminal catalytic domain containing protein	0.004	0.1042	0.1357
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0225	0.0259
Trichomonas vaginalis	Clan CD, family C14, metacaspase-like cysteine peptidase	0.0028	0.0443	0.0443
Echinococcus granulosus	sentrin specific protease 8	0.0096	0.3674	0.4788
Echinococcus granulosus	GPCR family 2	0.0019	0.0039	0.0051
Brugia malayi	Ulp1 protease family, C-terminal catalytic domain containing protein	0.004	0.1042	0.12
Entamoeba histolytica	acyl-coA synthetase, putative	0.0023	0.0225	0.0293
Schistosoma mansoni	caspase-7 (C14 family)	0.0103	0.4021	0.524
Trichomonas vaginalis	Clan CD, family C14, metacaspase-like cysteine peptidase	0.0028	0.0443	0.0443
Loa Loa (eye worm)	hypothetical protein	0.004	0.1042	0.12
Trichomonas vaginalis	Clan CE, family C48, Ulp1-like cysteine peptidase	0.004	0.1042	0.1042
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0019	0.0039	0.0051
Onchocerca volvulus		0.0027	0.0393	0.0172
Brugia malayi	Cell death protein 3 precursor	0.0028	0.0443	0.0511
Trichomonas vaginalis	conserved hypothetical protein	0.0028	0.0443	0.0443
Entamoeba histolytica	Ulp1 protease family, C-terminal catalytic domain containing protein	0.004	0.1042	0.1357
Trypanosoma cruzi	metacaspase, putative	0.0028	0.0443	0.1207
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0019	0.0039	0.0051
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.1752	0.2283
Trichomonas vaginalis	conserved hypothetical protein	0.0028	0.0443	0.0443
Schistosoma mansoni	hypothetical protein	0.0019	0.0039	0.0051
Plasmodium vivax	hypothetical protein, conserved	0.0028	0.0443	0.4256
Onchocerca volvulus		0.0027	0.0393	0.0172
Onchocerca volvulus		0.0027	0.0393	0.0172
Echinococcus multilocularis	caspase	0.0103	0.4021	0.524
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0027	0.0393	1
Schistosoma mansoni	transient receptor potential channel 4	0.0117	0.4685	0.6105
Loa Loa (eye worm)	hypothetical protein	0.004	0.1042	0.12
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0023	0.0225	0.5
Echinococcus multilocularis	caspase 2	0.0028	0.0443	0.0578
Trichomonas vaginalis	Clan CE, family C48, Ulp1-like cysteine peptidase	0.004	0.1042	0.1042
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0019	0.0039	0.0051
Echinococcus granulosus	caspase 3	0.0076	0.2715	0.3538
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0393	0.0453
Brugia malayi	Ulp1 protease family, C-terminal catalytic domain containing protein	0.0096	0.3674	0.4232
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0028	0.0456	0.0594
Brugia malayi	Carboxylesterase family protein	0.0157	0.6568	0.7566
Brugia malayi	Calcitonin receptor-like protein seb-1	0.006	0.1987	0.2289
Plasmodium falciparum	sentrin-specific protease 1	0.004	0.1042	1
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0023	0.0225	0.5718
Trypanosoma brucei	metacaspase MCA2	0.0028	0.0443	0.4256
Loa Loa (eye worm)	hypothetical protein	0.0044	0.1201	0.1383
Echinococcus multilocularis	carboxylesterase 5A	0.0157	0.6568	0.8559
Echinococcus multilocularis	neuroligin	0.0027	0.0393	0.0512
Schistosoma mansoni	family C48 unassigned peptidase (C48 family)	0.0096	0.3674	0.4788
Toxoplasma gondii	ICE family protease (caspase) p20 domain-containing protein	0.0028	0.0443	0.4256
Brugia malayi	Carboxylesterase family protein	0.0157	0.6568	0.7566
Echinococcus multilocularis	sentrin specific protease 7	0.018	0.7674	1
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0027	0.0393	0.0512
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0393	0.0453
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.006	0.1987	0.2289
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0443	0.0511
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0029	0.0506	0.066
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0023	0.0225	0.5718
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0027	0.0393	1
Echinococcus granulosus	caspase 2	0.0028	0.0443	0.0578
Entamoeba histolytica	hypothetical protein	0.0037	0.0908	0.1183
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.0225	0.5718
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0029	0.0506	0.4862
Trichomonas vaginalis	conserved hypothetical protein	0.0028	0.0443	0.0443
Schistosoma mansoni	gliotactin	0.0027	0.0393	0.0512
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.1752	0.2283
Entamoeba histolytica	Ulp1 protease family, C-terminal catalytic domain containing protein	0.004	0.1042	0.1357
Echinococcus granulosus	TRP transient receptor potential channel	0.0044	0.1201	0.1565
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0023	0.0225	0.5718
Plasmodium vivax	sentrin-specific protease 1, putative	0.004	0.1042	1
Mycobacterium ulcerans	hypothetical protein	0.0023	0.0225	0.5718
Schistosoma mansoni	transient receptor potential channel	0.0078	0.2807	0.3658
Entamoeba histolytica	hypothetical protein	0.0037	0.0908	0.1183
Leishmania major	SUMO1/Ulp2, putative,cysteine peptidase, Clan CA, family C48, putative	0.004	0.1042	1
Brugia malayi	Pre-SET motif family protein	0.0029	0.0506	0.0583
Brugia malayi	AMP-binding enzyme family protein	0.0023	0.0225	0.0259
Trichomonas vaginalis	Clan CE, family C48, Ulp1-like cysteine peptidase	0.0096	0.3674	0.3674
Leishmania major	4-coumarate:coa ligase-like protein	0.0023	0.0225	0.2158
Entamoeba histolytica	Ulp1 protease family, C-terminal catalytic domain containing protein	0.0096	0.3674	0.4788
Plasmodium falciparum	metacaspase-like protein	0.0028	0.0443	0.4256
Trypanosoma brucei	metacaspase MCA3	0.0028	0.0443	0.4256
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0055	0.1752	0.2018
Echinococcus granulosus	short transient receptor potential channel 6	0.0078	0.2807	0.3658
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0027	0.0393	0.0512
Trichomonas vaginalis	Clan CD, family C14, metacaspase-like cysteine peptidase	0.0028	0.0443	0.0443
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0393	0.0453
Brugia malayi	AMP-binding enzyme family protein	0.0023	0.0225	0.0259
Echinococcus granulosus	carboxylesterase 5A	0.0157	0.6568	0.8559
Trichomonas vaginalis	sentrin/sumo-specific protease, senp8, putative	0.004	0.1042	0.1042
Trichomonas vaginalis	spcc417.12 protein, putative	0.0027	0.0393	0.0393
Brugia malayi	Pre-SET motif family protein	0.0202	0.8681	1
Loa Loa (eye worm)	hypothetical protein	0.006	0.1987	0.2289
Schistosoma mansoni	acetylcholinesterase	0.0027	0.0393	0.0512
Trichomonas vaginalis	conserved hypothetical protein	0.004	0.1042	0.1042
Schistosoma mansoni	hypothetical protein	0.0037	0.0908	0.1183
Echinococcus multilocularis	expressed conserved protein	0.014	0.577	0.7519
Chlamydia trachomatis	deubiquitinase/deneddylase Dub1	0.004	0.1042	0.5
Onchocerca volvulus	Cell death protein 3 homolog	0.0028	0.0443	0.0224
Echinococcus multilocularis	acetylcholinesterase	0.0157	0.6568	0.8559
Echinococcus multilocularis	BC026374 protein (S09 family)	0.0027	0.0393	0.0512
Trichomonas vaginalis	Sentrin-specific protease, putative	0.0096	0.3674	0.3674
Brugia malayi	Transient-receptor-potential like protein	0.0044	0.1201	0.1383
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.0225	0.5718
Echinococcus multilocularis	transient receptor potential gamma protein	0.0117	0.4685	0.6105
Leishmania major	4-coumarate:coa ligase-like protein	0.0023	0.0225	0.2158
Trichomonas vaginalis	Clan CD, family C14, metacaspase-like cysteine peptidase	0.0028	0.0443	0.0443
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0039	0.0045
Schistosoma mansoni	neuroligin 3 (S09 family)	0.0027	0.0393	0.0512
Loa Loa (eye worm)	carboxylesterase	0.0157	0.6568	0.7566
Trypanosoma cruzi	SUMO1/Ulp2, putative	0.004	0.1042	0.2835
Trypanosoma brucei	Metacaspase-4	0.0028	0.0443	0.4256
Trichomonas vaginalis	conserved hypothetical protein	0.0028	0.0443	0.0443
Trichomonas vaginalis	carboxylesterase domain containing protein, putative	0.0027	0.0393	0.0393
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0393	0.0453
Echinococcus multilocularis	para nitrobenzyl esterase	0.0027	0.0393	0.0512
Trichomonas vaginalis	Clan CD, family C14, metacaspase-like cysteine peptidase	0.0028	0.0443	0.0443
Trichomonas vaginalis	Clan CE, family C48, Ulp1-like cysteine peptidase	0.004	0.1042	0.1042
Plasmodium vivax	sentrin-specific protease 2, putative	0.004	0.1042	1
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0023	0.0225	0.0293
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.1752	0.2283
Loa Loa (eye worm)	Ulp1 protease	0.0096	0.3674	0.4232
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.0225	0.5718
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0023	0.0225	0.5718
Echinococcus multilocularis	sentrin specific protease 8	0.0096	0.3674	0.4788
Loa Loa (eye worm)	hypothetical protein	0.0157	0.6568	0.7566
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0029	0.0506	0.066
Giardia lamblia	Sentrin specific protease, putative	0.004	0.1042	1
Echinococcus multilocularis	caspase 3	0.0076	0.2715	0.3538
Brugia malayi	mucosa associated lymphoid tissue lymphoma translocation protein 1	0.0028	0.0443	0.0511
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.006	0.1987	0.2289
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0037	0.0908	0.1183
Brugia malayi	Ulp1 protease family, C-terminal catalytic domain containing protein	0.004	0.1042	0.12
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0393	0.0453
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0443	0.0511
Loa Loa (eye worm)	Ulp1 protease	0.004	0.1042	0.12
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0393	0.0453
Toxoplasma gondii	Ulp1 protease family, C-terminal catalytic domain-containing protein	0.004	0.1042	1
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0019	0.0039	0.0045
Entamoeba histolytica	Ulp1 protease family, C-terminal catalytic domain containing protein	0.004	0.1042	0.1357

Activities

Activity type	Activity value	Assay description	Source	Reference
EC50 (functional)	13.3333 uM	PUBCHEM_BIOASSAY: Confirmation dose response assay for compounds that inhibit transient receptor potential cation channel C4 (TRPC4). (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2247, AID2256]	ChEMBL.	No reference
Potency (functional)	= 7.0795 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Influenza NS1 Protein Function. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	7.9433 uM	PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	8.9125 uM	PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	8.9125 uM	PubChem BioAssay. qHTS for Activators of Integrin-Mediated Alleviation for Muscular Dystrophy. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	12.5893 uM	PubChem BioAssay. qHTS for Antagonists of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	26.8545 uM	PUBCHEM_BIOASSAY: qHTS profiling assay for firefly luciferase inhibitor/activator using purified enzyme and Km concentrations of substrates (counterscreen for miR-21 project). (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2288, AID2289, AID2598, AID411]	ChEMBL.	No reference
Potency (functional)	39.8107 uM	PubChem BioAssay. qHTS for Antagonist of cAMP-regulated guanine nucleotide exchange factor 3 (EPAC1): primary screen. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	89.1251 uM	PubChem BioAssay. qHTS of PTHR Inhibitors: Primary Screen. (Class of assay: confirmatory)	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: CHEMBL1484077

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1340076