TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 520.68 | Formula: C28H45FN4O4
H donors: 3 H acceptors: 2 LogP: 4.6 Rotable bonds: 16
Rule of 5 violations (Lipinski): 2
SMILES: CCNC[C@@H](NC(=O)N1CCC[C@H](C1)[C@H](c1cccc(c1)F)OCCNC(=O)OC)CC1CCCCC1
InChi: 1S/C28H45FN4O4/c1-3-30-19-25(17-21-9-5-4-6-10-21)32-27(34)33-15-8-12-23(20-33)26(22-11-7-13-24(29)18-22)37-16-14-31-28(35)36-2/h7,11,13,18,21,23,25-26,30H,3-6,8-10,12,14-17,19-20H2,1-2H3,(H,31,35)(H,32,34)/t23-,25+,26+/m1/s1
InChiKey: QQQBTMKFQZSGIO-AFESJLNVSA-N

Network

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Target Layer

Model Organisms

Species	Viewmode
Arabidopsis thaliana
Caenorhabditis elegans
Dictyostelium discoideum
Drosophila melanogaster
Escherichia coli
Homo sapiens
Mus musculus
Oryza sativa
Saccharomyces cerevisiae
Schmidtea mediterranea
Other organisms

TDR Pathogens:

Species	Viewmode
Brugia malayi
Chlamydia trachomatis
Echinococcus granulosus
Entamoeba histolytica
Echinococcus multilocularis
Giardia lamblia
Leishmania major
Loa Loa (eye worm)
Mycobacterium leprae
Mycobacterium tuberculosis
Mycobacterium ulcerans
Onchocerca volvulus
Plasmodium falciparum
Plasmodium vivax
Schistosoma mansoni
Trypanosoma brucei
Trypanosoma cruzi
Toxoplasma gondii
Treponema pallidum
Trichomonas vaginalis
Wolbachia endosymbiont of Brugia malayi

Other Pathogens:

Species	Viewmode
Babesia bovis
Candida albicans
Cryptosporidium hominis
Cryptosporidium parvum
Leishmania braziliensis
Leishmania donovani
Leishmania infantum
Leishmania mexicana
Neospora caninum
Plasmodium berghei
Plasmodium knowlesi
Plasmodium yoelii
Schistosoma japonicum
Trypanosoma brucei gambiense
Trypanosoma congolense
Theileria parva

Compound Layer

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Clustering layers

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	renin	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Plasmodium yoelii	plasmepsin	Get druggable targets OG5_126885	All targets in OG5_126885
Echinococcus multilocularis	cathepsin d (lysosomal aspartyl protease)	Get druggable targets OG5_126885	All targets in OG5_126885
Theileria parva	pepsinogen, putative	Get druggable targets OG5_126885	All targets in OG5_126885
Candida albicans	vacuolar aspartic proteinase precursor similar to S. cerevisiae PEP4 (YPL154C)	Get druggable targets OG5_126885	All targets in OG5_126885
Schistosoma mansoni	subfamily A1A unassigned peptidase (A01 family)	Get druggable targets OG5_126885	All targets in OG5_126885
Theileria parva	cathepsin E, putative	Get druggable targets OG5_126885	All targets in OG5_126885
Schistosoma japonicum	ko:K01379 cathepsin D [EC3.4.23.5], putative	Get druggable targets OG5_126885	All targets in OG5_126885
Plasmodium falciparum	plasmepsin IV	Get druggable targets OG5_126885	All targets in OG5_126885
Plasmodium vivax	plasmepsin IV, putative	Get druggable targets OG5_126885	All targets in OG5_126885
Schistosoma mansoni	cathepsin D (A01 family)	Get druggable targets OG5_126885	All targets in OG5_126885
Plasmodium knowlesi	plasmepsin IV, putative	Get druggable targets OG5_126885	All targets in OG5_126885
Cryptosporidium parvum	membrane bound aspartyl proteinase with a signal peptide plus transmembrane domain	Get druggable targets OG5_126885	All targets in OG5_126885
Plasmodium falciparum	plasmepsin II	Get druggable targets OG5_126885	All targets in OG5_126885
Trichomonas vaginalis	Clan AA, family A1, cathepsin D-like aspartic peptidase	Get druggable targets OG5_126885	All targets in OG5_126885
Schistosoma japonicum	Cathepsin D precursor, putative	Get druggable targets OG5_126885	All targets in OG5_126885
Schistosoma mansoni	cathepsin D (A01 family)	Get druggable targets OG5_126885	All targets in OG5_126885
Plasmodium berghei	plasmepsin VI	Get druggable targets OG5_126885	All targets in OG5_126885
Plasmodium yoelii	hypothetical protein	Get druggable targets OG5_126885	All targets in OG5_126885
Plasmodium berghei	plasmepsin IV	Get druggable targets OG5_126885	All targets in OG5_126885
Toxoplasma gondii	aspartyl protease ASP1	Get druggable targets OG5_126885	All targets in OG5_126885
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_126885	All targets in OG5_126885
Plasmodium falciparum	plasmepsin I	Get druggable targets OG5_126885	All targets in OG5_126885
Neospora caninum	Pepsinogen A1, related	Get druggable targets OG5_126885	All targets in OG5_126885
Plasmodium vivax	aspartyl proteinase, putative	Get druggable targets OG5_126885	All targets in OG5_126885
Plasmodium falciparum	plasmepsin VI	Get druggable targets OG5_126885	All targets in OG5_126885
Neospora caninum	Renin, related	Get druggable targets OG5_126885	All targets in OG5_126885
Loa Loa (eye worm)	aspartic protease BmAsp-2	Get druggable targets OG5_126885	All targets in OG5_126885
Babesia bovis	eukaryotic aspartyl protease family protein	Get druggable targets OG5_126885	All targets in OG5_126885
Cryptosporidium hominis	aspartyl protease precursor	Get druggable targets OG5_126885	All targets in OG5_126885
Plasmodium knowlesi	aspartyl protease, putative	Get druggable targets OG5_126885	All targets in OG5_126885
Echinococcus granulosus	cathepsin d lysosomal aspartyl protease	Get druggable targets OG5_126885	All targets in OG5_126885
Toxoplasma gondii	aspartyl proteinase (eimepsin), putative	Get druggable targets OG5_126885	All targets in OG5_126885
Candida albicans	vacuolar aspartic proteinase precursor similar to S. cerevisiae PEP4 (YPL154C)	Get druggable targets OG5_126885	All targets in OG5_126885
Plasmodium yoelii	hypothetical protein	Get druggable targets OG5_126885	All targets in OG5_126885

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Plasmodium falciparum	plasmepsin X	renin	406 aa	352 aa	26.4 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0054	0.1232	0.1771
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0319	1	1
Trypanosoma cruzi	PAB1-binding protein , putative	0.0028	0.034	0.1196
Trichomonas vaginalis	CAMK family protein kinase	0.0103	0.2845	0.2277
Schistosoma mansoni	fructose 16-bisphosphate aldolase	0.0099	0.2714	0.523
Schistosoma mansoni	serine/threonine protein kinase	0.0103	0.2845	0.5482
Schistosoma mansoni	alpha-glucosidase	0.0153	0.4501	0.8672
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0033	0.0508	0.0979
Toxoplasma gondii	fructose-1,6-bisphosphate aldolase	0.0099	0.2714	1
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0018	0.0034	0.0075
Brugia malayi	Glycosyl hydrolases family 31 protein	0.0039	0.0736	0.1058
Loa Loa (eye worm)	fructose-bisphosphate aldolase 2	0.0099	0.2714	0.3902
Schistosoma mansoni	alpha-glucosidase	0.0153	0.4501	0.8672
Trypanosoma brucei	PAB1-binding protein , putative	0.0028	0.034	0.1196
Brugia malayi	hypothetical protein	0.0018	0.0017	0.0025
Loa Loa (eye worm)	hypothetical protein	0.0059	0.1383	0.1987
Trichomonas vaginalis	Clan AA, family A1, cathepsin D-like aspartic peptidase	0.0059	0.1383	0.0698
Echinococcus granulosus	fructose 16 bisphosphate aldolase	0.0099	0.2714	0.5101
Loa Loa (eye worm)	glycosyl hydrolase family 31 protein	0.0178	0.5321	0.765
Loa Loa (eye worm)	glycosyl hydrolase family 31 protein	0.0039	0.0736	0.1058
Echinococcus multilocularis	lysosomal alpha glucosidase	0.0178	0.5321	1
Plasmodium vivax	SET domain protein, putative	0.0033	0.0508	0.1873
Leishmania major	4-coumarate:coa ligase-like protein	0.0026	0.0286	0.1006
Entamoeba histolytica	serine/threonine protein kinase, putative	0.0103	0.2845	0.2634
Plasmodium vivax	acyl-CoA synthetase, putative	0.0019	0.0069	0.0255
Leishmania major	hypothetical protein, conserved	0.0028	0.034	0.1196
Entamoeba histolytica	glycosyl hydrolase, family 31 protein	0.0039	0.0736	0.0463
Plasmodium falciparum	ataxin-2 like protein, putative	0.0028	0.034	0.1254
Trichomonas vaginalis	CAMK family protein kinase	0.0051	0.112	0.0414
Trypanosoma cruzi	polo-like protein kinase, putative	0.0103	0.2845	1
Entamoeba histolytica	glycosyl hydrolase, family 31 protein	0.0039	0.0736	0.0463
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.005	0.1083	0.1557
Trichomonas vaginalis	CAMK family protein kinase	0.0103	0.2845	0.2277
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0069	0.01
Leishmania major	protein kinase, putative,polo-like protein kinase, putative	0.0103	0.2845	1
Onchocerca volvulus		0.0033	0.0508	0.0288
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0026	0.0286	0.0479
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0319	1	1
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0026	0.0286	0.0479
Loa Loa (eye worm)	hypothetical protein	0.0054	0.1232	0.1771
Mycobacterium ulcerans	acyl-CoA synthetase	0.0026	0.0286	0.0479
Echinococcus granulosus	fructose 16 bisphosphate aldolase	0.0099	0.2714	0.5101
Echinococcus granulosus	neutral alpha glucosidase AB	0.0039	0.0736	0.1383
Leishmania major	4-coumarate:coa ligase-like protein	0.0026	0.0286	0.1006
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0227	0.6956	1
Schistosoma mansoni	kinase	0.0052	0.1165	0.2245
Schistosoma mansoni	subfamily A1A unassigned peptidase (A01 family)	0.0059	0.1383	0.2664
Echinococcus multilocularis	fructose 1,6 bisphosphate aldolase	0.0099	0.2714	0.5101
Brugia malayi	AMP-binding enzyme family protein	0.0026	0.0286	0.0411
Brugia malayi	Pre-SET motif family protein	0.0033	0.0508	0.0731
Trypanosoma brucei	glucosidase, putative	0.0039	0.0736	0.2587
Loa Loa (eye worm)	PLK/PLK1 protein kinase	0.0103	0.2845	0.409
Trypanosoma cruzi	polo-like protein kinase, putative	0.0103	0.2845	1
Toxoplasma gondii	fructose-1,6-bisphosphate aldolase	0.0099	0.2714	1
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0033	0.0508	0.0979
Plasmodium vivax	plasmepsin IV, putative	0.0059	0.1383	0.5094
Toxoplasma gondii	LsmAD domain-containing protein	0.0028	0.034	0.1254
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.005	0.1083	0.2035
Echinococcus granulosus	fructose bisphosphate aldolase class I	0.0099	0.2714	0.5101
Trypanosoma cruzi	fructose-bisphosphate aldolase, glycosomal, putative	0.0099	0.2714	0.954
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.005	0.1083	0.2035
Mycobacterium leprae	Probable fructose bisphosphate aldolase Fba	0.0156	0.4593	1
Mycobacterium ulcerans	hypothetical protein	0.0026	0.0286	0.0479
Brugia malayi	fructose-bisphosphate aldolase 1	0.0099	0.2714	0.3902
Echinococcus multilocularis	fructose bisphosphate aldolase class I	0.0099	0.2714	0.5101
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0019	0.0069	0.0151
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.005	0.1083	0.2035
Brugia malayi	hypothetical protein	0.0028	0.034	0.0489
Brugia malayi	AMP-binding enzyme family protein	0.0026	0.0286	0.0411
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0319	1	1
Trichomonas vaginalis	CAMK family protein kinase	0.0103	0.2845	0.2277
Toxoplasma gondii	fructose-bisphosphate aldolase, putative	0.0099	0.2714	1
Chlamydia trachomatis	acylglycerophosphoethanolamine acyltransferase	0.0019	0.0069	0.5
Trichomonas vaginalis	CAMK family protein kinase	0.0103	0.2845	0.2277
Schistosoma mansoni	fructose 16-bisphosphate aldolase	0.0099	0.2714	0.523
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0319	1	1
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0026	0.0286	0.0479
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0286	0.0411
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0319	1	1
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0286	0.0411
Plasmodium falciparum	plasmepsin IV	0.0059	0.1383	0.5094
Plasmodium vivax	aspartyl proteinase, putative	0.0059	0.1383	0.5094
Onchocerca volvulus	Serine\/threonine kinase homolog	0.0103	0.2845	0.3319
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0018	0.0034	0.0075
Echinococcus multilocularis	cathepsin d (lysosomal aspartyl protease)	0.0059	0.1383	0.2598
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0033	0.0508	0.1873
Mycobacterium ulcerans	fructose-bisphosphate aldolase	0.0156	0.4593	1
Onchocerca volvulus		0.0103	0.2837	0.3308
Plasmodium falciparum	plasmepsin VI	0.0059	0.1383	0.5094
Schistosoma mansoni	cathepsin D (A01 family)	0.0174	0.519	1
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0026	0.0286	0.0623
Toxoplasma gondii	aspartyl protease ASP1	0.0059	0.1383	0.5094
Trichomonas vaginalis	CAMK family protein kinase	0.0051	0.112	0.0414
Echinococcus multilocularis	neutral alpha glucosidase AB	0.0039	0.0736	0.1383
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0319	1	1
Trypanosoma cruzi	fructose-bisphosphate aldolase, glycosomal, putative	0.0099	0.2714	0.954
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0069	0.01
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.005	0.1083	0.2087
Toxoplasma gondii	glycosyl hydrolase, family 31 protein	0.0039	0.0736	0.2712
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0026	0.0286	0.0623
Plasmodium vivax	ataxin-2 like protein, putative	0.0028	0.034	0.1254
Schistosoma mansoni	cathepsin D (A01 family)	0.0174	0.519	1
Trypanosoma cruzi	fructose-bisphosphate aldolase, glycosomal, putative	0.0099	0.2714	0.954
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0018	0.0034	0.0075
Mycobacterium ulcerans	acyl-CoA synthetase	0.0026	0.0286	0.0479
Mycobacterium tuberculosis	Probable fructose-bisphosphate aldolase Fba	0.0156	0.4593	1
Trichomonas vaginalis	CAMK family protein kinase	0.0103	0.2845	0.2277
Onchocerca volvulus		0.0259	0.7996	1
Trypanosoma cruzi	hypothetical protein, conserved	0.0039	0.0736	0.2587
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0286	0.0411
Echinococcus granulosus	serine:threonine protein kinase PLK1	0.0103	0.2845	0.5347
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0054	0.1232	0.1771
Trypanosoma cruzi	fructose-bisphosphate aldolase, glycosomal, putative	0.0099	0.2714	0.954
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0069	0.01
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0031	0.0469	0.088
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0319	1	1
Brugia malayi	Pre-SET motif family protein	0.0227	0.6956	1
Echinococcus multilocularis	serine:threonine protein kinase PLK1	0.0103	0.2845	0.5347
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0054	0.1232	0.1771
Echinococcus multilocularis	lysosomal alpha glucosidase	0.0178	0.5321	1
Trypanosoma cruzi	hypothetical protein, conserved	0.0039	0.0736	0.2587
Leishmania major	4-coumarate:coa ligase-like protein	0.0026	0.0286	0.1006
Echinococcus multilocularis	fructose 1,6 bisphosphate aldolase	0.0099	0.2714	0.5101
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0033	0.0508	0.0979
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0319	1	1
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0508	0.0731
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.005	0.1083	0.2087
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.005	0.1083	0.1557
Trypanosoma brucei	fructose-bisphosphate aldolase, glycosomal, putative	0.0099	0.2714	0.954
Treponema pallidum	fructose-bisphosphate aldolase	0.0319	1	0.5
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0033	0.0508	0.0955
Plasmodium falciparum	ataxin-2 like protein, putative	0.0028	0.034	0.1254
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0033	0.0508	0.0979
Echinococcus multilocularis	fructose 1,6 bisphosphate aldolase	0.0099	0.2714	0.5101
Trypanosoma brucei	polo-like protein kinase	0.0103	0.2845	1
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0069	0.01
Plasmodium falciparum	plasmepsin I	0.0059	0.1383	0.5094
Loa Loa (eye worm)	hypothetical protein	0.0028	0.034	0.0489
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0026	0.0286	0.0479
Mycobacterium ulcerans	acyl-CoA synthetase	0.0026	0.0286	0.0479
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.005	0.1083	0.2035
Brugia malayi	serine/threonine-protein kinase plk-2	0.0103	0.2845	0.409
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0018	0.0034	0.0075
Schistosoma mansoni	hypothetical protein	0.0037	0.0661	0.1274
Giardia lamblia	Fructose-bisphosphate aldolase	0.0319	1	1
Brugia malayi	latrophilin 2 splice variant baaae	0.0037	0.0661	0.095
Trichomonas vaginalis	CAMK family protein kinase	0.0103	0.2845	0.2277
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0033	0.0508	0.0955
Echinococcus granulosus	fructose 16 bisphosphate aldolase	0.0099	0.2714	0.5101
Loa Loa (eye worm)	aspartic protease BmAsp-2	0.0059	0.1383	0.1987
Trichomonas vaginalis	set domain proteins, putative	0.0259	0.7996	0.7837
Plasmodium vivax	fructose 1,6-bisphosphate aldolase, putative	0.0099	0.2714	1
Brugia malayi	fructose-bisphosphate aldolase 2	0.0099	0.2714	0.3902
Plasmodium falciparum	acyl-CoA synthetase	0.0019	0.0069	0.0255
Echinococcus granulosus	histone lysine methyltransferase setb	0.0033	0.0508	0.0955
Trichomonas vaginalis	CAMK family protein kinase	0.0103	0.2845	0.2277
Plasmodium falciparum	fructose-bisphosphate aldolase	0.0099	0.2714	1
Schistosoma mansoni	alpha glucosidase	0.0039	0.0736	0.1419
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.005	0.1083	0.2087
Loa Loa (eye worm)	fructose-bisphosphate aldolase 1	0.0099	0.2714	0.3902
Brugia malayi	Glycosyl hydrolases family 31 protein	0.0178	0.5321	0.765
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0319	1	1
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0069	0.01
Echinococcus granulosus	lysosomal alpha glucosidase	0.0178	0.5321	1
Echinococcus granulosus	cathepsin d lysosomal aspartyl protease	0.0059	0.1383	0.2598
Leishmania major	fructose-1,6-bisphosphate aldolase	0.0099	0.2714	0.954
Trypanosoma cruzi	PAB1-binding protein , putative	0.0028	0.034	0.1196
Brugia malayi	AMP-binding enzyme family protein	0.0026	0.0286	0.0411
Toxoplasma gondii	aspartyl proteinase (eimepsin), putative	0.0059	0.1383	0.5094
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0661	0.095
Plasmodium falciparum	plasmepsin II	0.0059	0.1383	0.5094
Leishmania major	alpha glucosidase II subunit, putative	0.0039	0.0736	0.2587

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 2.1 nM	Inhibition of trypsin-activated human recombinant renin	ChEMBL.	19959358
IC50 (binding)	= 18 nM	Inhibition of human recombinant renin assessed as decrease in plasma renin activity by competitive radioimmunoassay in presence of human plasma	ChEMBL.	19959358

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: CHEMBL591104

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1086153