TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 483.006 | Formula: C25H31ClN6O2
H donors: 1 H acceptors: 5 LogP: 5.11 Rotable bonds: 11
Rule of 5 violations (Lipinski): 1
SMILES: CC(CN(C(=O)c1cc(C)cc(c1)C(=O)NCc1cc(Cl)ccc1n1cnnn1)CC(C)C)C
InChi: 1S/C25H31ClN6O2/c1-16(2)13-31(14-17(3)4)25(34)20-9-18(5)8-19(10-20)24(33)27-12-21-11-22(26)6-7-23(21)32-15-28-29-30-32/h6-11,15-17H,12-14H2,1-5H3,(H,27,33)
InChiKey: UCFKGQMFQFFVQN-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

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	coagulation factor II (thrombin)	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

No druggable targets predicted by orthology data

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Giardia lamblia	Kinase, NEK	0.0002	0.000000096934	0.0001
Giardia lamblia	Kinase, NEK	0.0002	0.0014	1
Schistosoma mansoni	hypothetical protein	0.0021	0.1396	0.1396
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0003	0.0076	0.0076
Entamoeba histolytica	hypothetical protein	0.002	0.1308	1
Loa Loa (eye worm)	hypothetical protein	0.0003	0.0076	0.0084
Echinococcus multilocularis	Ankyrin	0.0002	0.000000096934	0.000000097072
Echinococcus granulosus	glycoprotein Antigen 5	0.0003	0.0076	0.0076
Trichomonas vaginalis	protein phosphatase 1 regulatory subunit 12C, putative	0.0002	0.0014	0.0109
Schistosoma mansoni	cercarial elastase (S01 family)	0.0003	0.0076	0.0076
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0758	0.0833
Echinococcus multilocularis	poly (ADP ribose) polymerase 1	0.002	0.1308	0.131
Trichomonas vaginalis	protein phosphatase 1 regulatory subunit 12B, putative	0.0002	0.0001	0.0011
Schistosoma mansoni	cercarial elastase (S01 family)	0.0003	0.0076	0.0076
Giardia lamblia	Kinase, NEK	0.0002	0.0014	1
Toxoplasma gondii	Tyrosine kinase-like (TKL) protein	0.0012	0.0758	0.5432
Brugia malayi	hypothetical protein	0.0003	0.0076	0.0077
Echinococcus granulosus	SAM domain containing protein	0.0012	0.0758	0.0759
Echinococcus granulosus	Ankyrin	0.0002	0.000000096934	0.000000097072
Trichomonas vaginalis	ankyrin, putative	0.0002	0.000000096934	0.0000007409
Trichomonas vaginalis	ankyrin 2,3/unc44, putative	0.0002	0.000000096934	0.0000007409
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.0001	0.0011
Loa Loa (eye worm)	TK/ROR protein kinase	0.0021	0.1396	0.1534
Echinococcus multilocularis	tissue type plasminogen activator	0.0021	0.1396	0.1398
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.000000096934	0.0000007409
Trichomonas vaginalis	conserved hypothetical protein	0.0002	0.000000096934	0.0000007409
Echinococcus multilocularis	stromal interaction molecule 1	0.0012	0.0758	0.0759
Echinococcus granulosus	liprin beta 1	0.0012	0.0758	0.0759
Trichomonas vaginalis	ankyrin repeat domain protein, putative	0.0002	0.0038	0.0291
Echinococcus granulosus	enteropeptidase	0.0003	0.0076	0.0076
Echinococcus multilocularis	subfamily S1A unassigned peptidase (S01 family)	0.0003	0.0076	0.0076
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.000000096934	0.0000007409
Trichomonas vaginalis	conserved hypothetical protein	0.002	0.1308	1
Schistosoma mansoni	lip-related protein (liprin) alpha	0.0012	0.0758	0.0758
Trichomonas vaginalis	ankyrin 2,3/unc44, putative	0.0003	0.0054	0.0411
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.0016	0.012
Brugia malayi	Trypsin family protein	0.0003	0.0076	0.0077
Loa Loa (eye worm)	hypothetical protein	0.0003	0.0076	0.0084
Brugia malayi	Patatin-like phospholipase family protein	0.0002	0.000000096934	0.000000097923
Schistosoma mansoni	hypothetical protein	0.0012	0.0758	0.0758
Echinococcus granulosus	poly ADP ribose polymerase 1	0.002	0.1308	0.131
Schistosoma mansoni	lar interacting protein (lip)-related protein	0.0012	0.0758	0.0758
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.000000096934	0.0000007409
Echinococcus granulosus	Sterile alpha motif SAM	0.0012	0.0758	0.0759
Echinococcus granulosus	Peptidase S1 S6 chymotrypsin Hap	0.0003	0.0076	0.0076
Loa Loa (eye worm)	hypothetical protein	0.0002	0.0016	0.0017
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.000000096934	0.0000007409
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.000000096934	0.0000007409
Leishmania major	huntingtin interacting protein (HIP), putative	0.0002	0.0014	0.0102
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.004	0.0303
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.000000096934	0.0000007409
Loa Loa (eye worm)	hypothetical protein	0.0002	0.000000096934	0.00000010649
Schistosoma mansoni	sarm1	0.0012	0.0758	0.0758
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0003	0.0076	0.0076
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.0001	0.0011
Loa Loa (eye worm)	hypothetical protein	0.0003	0.0076	0.0084
Trichomonas vaginalis	2-5A-dependent ribonuclease, putative	0.0002	0.0014	0.0109
Schistosoma mansoni	hypothetical protein	0.0003	0.0076	0.0076
Schistosoma mansoni	hypothetical protein	0.0012	0.0758	0.0758
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.000000096934	0.0000007409
Loa Loa (eye worm)	tnks protein	0.0128	0.9103	1
Trichomonas vaginalis	ion channel nompc, putative	0.0002	0.0001	0.0011
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0758	0.0833
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.000000096934	0.0000007409
Plasmodium vivax	cysteine repeat modular protein 1, putative	0.0021	0.1396	1
Echinococcus multilocularis	tankyrase	0.014	0.9986	1
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.0001	0.0011
Onchocerca volvulus		0.0021	0.1396	0.156
Trichomonas vaginalis	ankyrin repeat and FYVE domain containing protein, putative	0.0002	0.0014	0.0109
Schistosoma mansoni	cercarial elastase (S01 family)	0.0003	0.0076	0.0076
Trichomonas vaginalis	nf kappa B inhibitor I-kappa-B, putative	0.0002	0.000000096934	0.0000007409
Brugia malayi	Kringle domain containing protein	0.0021	0.1396	0.141
Schistosoma mansoni	cercarial elastase (S01 family)	0.0003	0.0076	0.0076
Trichomonas vaginalis	ion channel nompc, putative	0.0002	0.0014	0.0109
Brugia malayi	hypothetical protein	0.0012	0.0758	0.0766
Onchocerca volvulus	Tankyrase homolog	0.0126	0.8951	1
Brugia malayi	WGR domain containing protein	0.002	0.1308	0.1322
Trichomonas vaginalis	conserved hypothetical protein	0.002	0.1308	1
Trypanosoma cruzi	poly(ADP-ribose) polymerase, putative	0.002	0.1308	0.9372
Brugia malayi	Tnks protein	0.0139	0.9899	1
Trichomonas vaginalis	conserved hypothetical protein	0.002	0.1308	1
Echinococcus granulosus	poly adp ribose polymerase 2	0.002	0.1308	0.131
Entamoeba histolytica	hypothetical protein	0.002	0.1308	1
Trichomonas vaginalis	multiple ankyrin repeats single kh domain protein, putative	0.0002	0.000000096934	0.0000007409
Brugia malayi	hypothetical protein	0.0012	0.0758	0.0766
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.000000096934	0.0000007409
Loa Loa (eye worm)	hypothetical protein	0.0003	0.0076	0.0084
Trichomonas vaginalis	inversin, putative	0.0002	0.0001	0.0011
Trichomonas vaginalis	ankyrin repeat domain protein, putative	0.0002	0.0014	0.0109
Trichomonas vaginalis	ankyrin repeat-rich membrane-spanning protein, putative	0.0002	0.0001	0.0011
Trichomonas vaginalis	conserved hypothetical protein	0.002	0.1308	1
Trichomonas vaginalis	protein phosphatase 1 regulatory subunit 12B, putative	0.0002	0.000000096934	0.0000007409
Trypanosoma brucei	Ankyrin repeats (many copies), putative	0.0002	0.000000096934	0.0000007409
Trichomonas vaginalis	ion channel nompc, putative	0.0002	0.000000096934	0.0000007409
Loa Loa (eye worm)	hypothetical protein	0.0002	0.000000096934	0.00000010649
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.000000096934	0.0000007409
Schistosoma mansoni	ga binding protein beta chain (transcription factor e4tf1-47)	0.0002	0.000000096934	0.000000096934
Trichomonas vaginalis	cortactin-binding protein, putative	0.0002	0.000000096934	0.0000007409
Mycobacterium ulcerans	hypothetical protein	0.0003	0.0076	0.5
Echinococcus multilocularis	Ankyrin	0.0002	0.0016	0.0016
Onchocerca volvulus		0.0003	0.0076	0.0085
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.0001	0.0011
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.000000096934	0.0000007409
Echinococcus granulosus	subfamily S1A unassigned peptidase S01 family	0.0003	0.0076	0.0076
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.000000096934	0.0000007409
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.000000096934	0.0000007409
Loa Loa (eye worm)	hypothetical protein	0.0106	0.7519	0.826
Onchocerca volvulus		0.0012	0.0758	0.0847
Trichomonas vaginalis	conserved hypothetical protein	0.0012	0.0758	0.5796
Trichomonas vaginalis	conserved hypothetical protein	0.0012	0.0758	0.5796
Brugia malayi	Trypsin family protein	0.0003	0.0076	0.0077
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.0014	0.0109
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.000000096934	0.0000007409
Trypanosoma brucei	poly(adp-ribose) polymerase	0.002	0.1308	1
Brugia malayi	Leucine Rich Repeat family protein	0.0002	0.000000096934	0.000000097923
Trichomonas vaginalis	ion channel nompc, putative	0.0002	0.0001	0.0011
Leishmania major	hypothetical protein, conserved	0.0021	0.1396	1
Trichomonas vaginalis	c2h2 zinc finger protein, putative	0.0012	0.0758	0.5796
Echinococcus granulosus	Mastin	0.0003	0.0076	0.0076
Trichomonas vaginalis	ankyrin repeat domain protein, putative	0.0002	0.0014	0.0109
Trichomonas vaginalis	conserved hypothetical protein	0.002	0.1308	1
Loa Loa (eye worm)	poly(ADP-ribose) polymerase	0.002	0.1308	0.1437
Echinococcus multilocularis	poly (adp ribose) polymerase 2	0.002	0.1308	0.131
Trichomonas vaginalis	conserved hypothetical protein	0.0012	0.0758	0.5796
Echinococcus multilocularis	liprin alpha 2	0.0012	0.0758	0.0759
Echinococcus granulosus	26S proteasome non ATPase regulatory subunit 10	0.0002	0.0001	0.0001
Entamoeba histolytica	zinc finger protein, putative	0.002	0.1308	1
Trichomonas vaginalis	ankyrin, putative	0.0002	0.000000096934	0.0000007409
Echinococcus multilocularis	ankyrin repeat domain containing protein 6	0.0002	0.000000096934	0.000000097072
Schistosoma mansoni	cercarial elastase (S01 family)	0.0003	0.0076	0.0076
Schistosoma mansoni	phospholipase	0.0002	0.000000096934	0.000000096934
Trichomonas vaginalis	unc-44 ankyrins, putative	0.0002	0.0014	0.0109
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.000000096934	0.0000007409
Entamoeba histolytica	hypothetical protein	0.002	0.1308	1
Loa Loa (eye worm)	hypothetical protein	0.0003	0.0076	0.0084
Echinococcus multilocularis	SAM domain containing protein	0.0012	0.0758	0.0759
Brugia malayi	Patatin-like phospholipase family protein	0.0002	0.0014	0.0014
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.0001	0.0011
Echinococcus granulosus	liprin alpha 2	0.0012	0.0758	0.0759
Entamoeba histolytica	poly(ADP-ribose) polymerase, putative	0.002	0.1308	1
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.000000096934	0.0000007409
Giardia lamblia	Kinase, NEK	0.0002	0.000000096934	0.0001
Echinococcus multilocularis	glycoprotein Antigen 5	0.0003	0.0076	0.0076
Onchocerca volvulus		0.0003	0.0076	0.0085
Onchocerca volvulus		0.0012	0.0758	0.0847
Trichomonas vaginalis	ankyrin repeat and FYVE domain containing protein, putative	0.0002	0.000000096934	0.0000007409
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.000000096934	0.0000007409
Echinococcus granulosus	E3 ubiquitin protein ligase mib1	0.0002	0.0014	0.0014
Trichomonas vaginalis	rolling pebbles, putative	0.0002	0.000000096934	0.0000007409
Brugia malayi	Liprin-alpha 2	0.0012	0.0758	0.0766
Echinococcus multilocularis	enteropeptidase	0.0003	0.0076	0.0076
Trichomonas vaginalis	26S proteasome non-ATPase regulatory subunit, putative	0.0002	0.000000096934	0.0000007409
Schistosoma mansoni	cercarial elastase (S01 family)	0.0003	0.0076	0.0076
Echinococcus granulosus	transmembrane protease serine 3	0.0003	0.0076	0.0076
Echinococcus granulosus	sterile alpha and tir motif containing protein	0.0012	0.0758	0.0759
Entamoeba histolytica	ankyrin repeat protein, putative	0.0002	0.000000096934	0.0000007409
Trichomonas vaginalis	cask-interacting protein (caskin) 1,2, putative	0.0002	0.000000096934	0.0000007409
Giardia lamblia	Protein 21.1	0.0002	0.000000096934	0.0001
Schistosoma mansoni	cercarial elastase (S01 family)	0.0003	0.0076	0.0076
Trichomonas vaginalis	ankyrin repeat-rich membrane-spanning protein, putative	0.0002	0.000000096934	0.0000007409
Trichomonas vaginalis	E3 ubiquitin protein ligase, putative	0.0002	0.0001	0.0011
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0003	0.0076	0.0076
Trichomonas vaginalis	homeobox-containing protein wariai, putative	0.0002	0.000000096934	0.0000007409
Echinococcus multilocularis	26S proteasome non ATPase regulatory subunit 10	0.0002	0.0001	0.0001
Schistosoma mansoni	poly [ADP-ribose] polymerase	0.002	0.1308	0.1308
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.0014	0.0109
Brugia malayi	sterile alpha and TIR motif containing protein 1 isoform a	0.0012	0.0758	0.0766
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.000000096934	0.0000007409
Trichomonas vaginalis	unc-44 ankyrins, putative	0.0002	0.000000096934	0.0000007409
Onchocerca volvulus		0.0003	0.0076	0.0085
Trypanosoma cruzi	poly(ADP-ribose) polymerase, putative	0.002	0.1308	0.9372
Trichomonas vaginalis	2-5A-dependent ribonuclease, putative	0.0002	0.000000096934	0.0000007409
Toxoplasma gondii	kringle domain-containing protein	0.0021	0.1396	1
Schistosoma mansoni	cercarial elastase (S01 family)	0.0003	0.0076	0.0076
Trypanosoma cruzi	palmitoyl acyltransferase 1, putative	0.0002	0.0014	0.0102
Brugia malayi	Uncoordinated protein 44	0.0002	0.0001	0.0002
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.000000096934	0.0000007409
Loa Loa (eye worm)	Notch2	0.0002	0.0001	0.0002
Echinococcus granulosus	tissue type plasminogen activator	0.0021	0.1396	0.1398
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0003	0.0076	0.0076
Trichomonas vaginalis	ankyrin, putative	0.0002	0.0014	0.0109
Trichomonas vaginalis	ankyrin repeat domain protein, putative	0.0002	0.0001	0.0011
Brugia malayi	Trypsin family protein	0.0003	0.0076	0.0077
Trichomonas vaginalis	ankyrin 2,3/unc44, putative	0.0002	0.0014	0.0109
Trichomonas vaginalis	ankyrin repeat and sam domain-containing protein, putative	0.0002	0.000000096934	0.0000007409
Brugia malayi	Chymotrypsin-like protease CTRL-1 precursor	0.0003	0.0076	0.0077
Onchocerca volvulus		0.0003	0.0076	0.0085
Loa Loa (eye worm)	hypothetical protein	0.002	0.1308	0.1437
Giardia lamblia	Protein 21.1	0.0002	0.000000096934	0.0001
Onchocerca volvulus		0.0003	0.0076	0.0085
Echinococcus granulosus	stromal interaction molecule 1	0.0012	0.0758	0.0759
Trichomonas vaginalis	serine/threonine-protein kinase ripk4, putative	0.0002	0.0001	0.0011
Schistosoma mansoni	26S proteasome subunit	0.0002	0.000000096934	0.000000096934
Trypanosoma cruzi	palmitoyl acyltransferase 1, putative	0.0002	0.0014	0.0102
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.0014	0.0109
Brugia malayi	Trypsin family protein	0.0003	0.0076	0.0077
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0003	0.0076	0.0076
Brugia malayi	Protein kinase domain containing protein	0.0021	0.1396	0.141
Schistosoma mansoni	poly [ADP-ribose] polymerase	0.002	0.1308	0.1308
Entamoeba histolytica	hypothetical protein	0.002	0.1308	1
Onchocerca volvulus		0.0003	0.0076	0.0085
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.0014	0.0109
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0758	0.0833
Loa Loa (eye worm)	hypothetical protein	0.0021	0.1396	0.1534
Echinococcus multilocularis	E3 ubiquitin protein ligase mib1	0.0002	0.0014	0.0014
Echinococcus granulosus	Ankyrin	0.0002	0.0014	0.0014
Brugia malayi	Trypsin-like protease protein 5	0.0003	0.0076	0.0077
Loa Loa (eye worm)	hypothetical protein	0.0002	0.000000096934	0.00000010649
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.0001	0.0011
Trichomonas vaginalis	tankyrase, putative	0.0002	0.0001	0.0011
Trichomonas vaginalis	fibronectin type 3 and ankyrin repeat domains, putative	0.0002	0.000000096934	0.0000007409
Loa Loa (eye worm)	trypsin family protein	0.0003	0.0076	0.0084
Schistosoma mansoni	cercarial elastase (S01 family)	0.0003	0.0076	0.0076
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0758	0.0833
Loa Loa (eye worm)	hypothetical protein	0.0002	0.000000096934	0.00000010649
Trichomonas vaginalis	ankyrin, putative	0.0002	0.0001	0.0011
Loa Loa (eye worm)	hypothetical protein	0.0003	0.0076	0.0084
Giardia lamblia	Ankyrin 1	0.0002	0.000000096934	0.0001
Brugia malayi	Neurabin protein 1	0.0012	0.0758	0.0766
Echinococcus multilocularis	sterile alpha and tir motif containing protein	0.0012	0.0758	0.0759
Toxoplasma gondii	poly(ADP-ribose) polymerase catalytic domain-containing protein	0.002	0.1308	0.9372
Schistosoma mansoni	cercarial elastase (S01 family)	0.0003	0.0076	0.0076
Trichomonas vaginalis	unc-44 ankyrins, putative	0.0002	0.0014	0.0109
Trichomonas vaginalis	conserved hypothetical protein	0.002	0.1308	1
Trypanosoma cruzi	hypothetical protein, conserved	0.0021	0.1396	1
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.000000096934	0.0000007409
Plasmodium falciparum	cysteine repeat modular protein 1	0.0021	0.1396	1
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0003	0.0076	0.0076
Trichomonas vaginalis	ankyrin, putative	0.0002	0.0001	0.0011
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0003	0.0076	0.0076
Trichomonas vaginalis	conserved hypothetical protein	0.002	0.1308	1
Giardia lamblia	Kinase, NEK-frag	0.0002	0.000000096934	0.0001
Trichomonas vaginalis	fetal globin-inducing factor, putative	0.0002	0.000000096934	0.0000007409
Echinococcus multilocularis	liprin beta 1	0.0012	0.0758	0.0759
Trichomonas vaginalis	sex-determining protein fem-1, putative	0.0002	0.000000096934	0.0000007409
Trichomonas vaginalis	2-5A-dependent ribonuclease, putative	0.0002	0.000000096934	0.0000007409
Trypanosoma brucei	palmitoyl acyltransferase 1, putative	0.0002	0.0014	0.0109
Trichomonas vaginalis	ankyrin, putative	0.0002	0.0016	0.012
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.0014	0.0109
Trypanosoma cruzi	ankyrin repeat protein, putative	0.0002	0.000000096934	0.0000006944
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.000000096934	0.0000007409
Schistosoma mansoni	cercarial elastase (S01 family)	0.0003	0.0076	0.0076
Schistosoma mansoni	aminopeptidase PILS (M01 family)	0.0003	0.0076	0.0076
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.0014	0.0109
Loa Loa (eye worm)	toll and interleukin 1 receptor domain-containing protein isoform f	0.0012	0.0758	0.0833
Trichomonas vaginalis	conserved hypothetical protein	0.002	0.1308	1
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0758	0.0833
Brugia malayi	WGR domain containing protein	0.002	0.1308	0.1322
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.000000096934	0.0000007409
Trichomonas vaginalis	conserved hypothetical protein	0.002	0.1308	1
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.000000096934	0.0000007409
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.0014	0.0109
Trichomonas vaginalis	mind bomb, putative	0.0002	0.000000096934	0.0000007409
Echinococcus granulosus	tankyrase	0.014	0.9986	1
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.0001	0.0011
Schistosoma mansoni	hypothetical protein	0.0012	0.0758	0.0758
Echinococcus multilocularis	Mastin	0.0003	0.0076	0.0076
Trichomonas vaginalis	ion channel nompc, putative	0.0002	0.000000096934	0.0000007409
Echinococcus multilocularis	Peptidase S1 S6, chymotrypsin Hap	0.0003	0.0076	0.0076
Schistosoma mansoni	hypothetical protein	0.0012	0.0758	0.0758
Schistosoma mansoni	ankyrin 23/unc44	0.0002	0.0014	0.0014
Echinococcus multilocularis	poly (ADP ribose) polymerase	0.002	0.1308	0.131
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.000000096934	0.0000007409
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0002	0.000000096934	0.0000007409
Schistosoma mansoni	hypothetical protein	0.0003	0.0076	0.0076
Echinococcus multilocularis	transmembrane protease serine 3	0.0003	0.0076	0.0076
Trichomonas vaginalis	ankyrin repeat domain protein, putative	0.0002	0.000000096934	0.0000007409
Brugia malayi	coiled-coil like protein 1	0.0012	0.0758	0.0766
Trichomonas vaginalis	ankyrin repeat domain-containing protein, putative	0.0002	0.0001	0.0011
Trichomonas vaginalis	conserved hypothetical protein	0.0012	0.0758	0.5796
Trichomonas vaginalis	multiple ankyrin repeats single kh domain protein, putative	0.0002	0.0014	0.0109
Loa Loa (eye worm)	hypothetical protein	0.0003	0.0076	0.0084

Activities

Activity type	Activity value	Assay description	Source	Reference
2aPTT (functional)	= 1.2 uM	Anticoagulant activity in human plasma assessed as concentration required to double activated partial thromboplastin time	ChEMBL.	21295467
Ki (binding)	= 0.27 nM	Inhibition of thrombin	ChEMBL.	21295467

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: CHEMBL1682777

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1506342