TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 467.278 | Formula: C27H37N3O4
H donors: 4 H acceptors: 4 LogP: 4.12 Rotable bonds: 15
Rule of 5 violations (Lipinski): 0
SMILES: ONC(=O)CC(C(=O)NC(C(C)(C)C)C(=O)NC(c1ccccc1)C)CCCc1ccccc1
InChi: InChI=1S/C27H37N3O4/c1-19(21-15-9-6-10-16-21)28-26(33)24(27(2,3)4)29-25(32)22(18-23(31)30-34)17-11-14-20-12-7-5-8-13-20/h5-10,12-13,15-16,19,22,24,34H,11,14,17-18H2,1-4H3,(H,28,33)(H,29,32)(H,30,31)
InChiKey: XAHWTAYXASVGFG-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	matrix metallopeptidase 2 (gelatinase A, 72kDa gelatinase, 72kDa type IV collagenase)		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
Trypanosoma cruzi	hypothetical protein, conserved	0.0038	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0588	0.4383	1
Schistosoma mansoni	subfamily M12A unassigned peptidase (M12 family)	0.0056	0.0138	0.0315
Echinococcus multilocularis	protein jagged 1	0.019	0.1209	0.2759
Brugia malayi	Hemopexin family protein	0.0067	0.023	0.0525
Echinococcus multilocularis	neurogenic locus notch protein	0.019	0.1209	0.2759
Onchocerca volvulus	Peroxidasin homolog	0.0588	0.4383	1
Echinococcus multilocularis	neurogenic locus protein delta	0.019	0.1209	0.2759
Mycobacterium tuberculosis	Probable flavin-containing monoamine oxidase AofH (amine oxidase) (MAO)	0.0311	0.2177	0.2177
Treponema pallidum	fructose-bisphosphate aldolase	0.0152	0.0906	0.0775
Loa Loa (eye worm)	hypothetical protein	0.019	0.1209	0.2759
Loa Loa (eye worm)	hypothetical protein	0.0196	0.1261	0.2877
Loa Loa (eye worm)	hypothetical protein	0.019	0.1209	0.2759
Loa Loa (eye worm)	hypothetical protein	0.0588	0.4383	1
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0152	0.0906	1
Echinococcus granulosus	neurogenic locus notch protein 4	0.019	0.1209	0.2759
Brugia malayi	Delta serrate ligand family protein	0.019	0.1209	0.2759
Onchocerca volvulus	Dual oxidase homolog	0.0588	0.4383	1
Loa Loa (eye worm)	hypothetical protein	0.019	0.1209	0.2759
Loa Loa (eye worm)	hypothetical protein	0.0192	0.1224	0.2792
Schistosoma mansoni	hypothetical protein	0.019	0.1209	0.2759
Brugia malayi	Transmembrane cell adhesion receptor mua-3 precursor, putative	0.0192	0.1224	0.2792
Echinococcus multilocularis	neurogenic locus notch protein	0.0192	0.1224	0.2792
Onchocerca volvulus	Peroxidasin homolog	0.0588	0.4383	1
Onchocerca volvulus		0.019	0.1209	0.2759
Schistosoma mansoni	hypothetical protein	0.005	0.0094	0.0215
Brugia malayi	Animal haem peroxidase family protein	0.0588	0.4383	1
Echinococcus multilocularis	fibropellin Ia	0.019	0.1209	0.2759
Echinococcus granulosus	3 hydroxyacyl coenzyme A dehydrogenase type 2	0.006	0.017	0.0388
Loa Loa (eye worm)	hypothetical protein	0.0192	0.1224	0.2792
Echinococcus multilocularis	ATP dependent Clp protease proteolytic subunit	0.0164	0.1007	0.2297
Brugia malayi	Animal haem peroxidase family protein	0.0588	0.4383	1
Brugia malayi	Matrixin family protein	0.0047	0.0072	0.0165
Echinococcus multilocularis	peroxidasin	0.0588	0.4383	1
Echinococcus granulosus	protein jagged 1	0.019	0.1209	0.2759
Echinococcus multilocularis	survival motor neuron protein 1	0.0246	0.1655	0.3776
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0049	0.0083	0.0189
Onchocerca volvulus	Putative cubilin	0.0196	0.1261	0.2877
Brugia malayi	Cadherin domain containing protein	0.019	0.1209	0.2759
Loa Loa (eye worm)	hypothetical protein	0.019	0.1209	0.2759
Plasmodium falciparum	ATP-dependent Clp protease proteolytic subunit	0.0164	0.1007	1
Loa Loa (eye worm)	hypothetical protein	0.0588	0.4383	1
Schistosoma mansoni	slit	0.019	0.1209	0.2759
Loa Loa (eye worm)	animal heme peroxidase	0.0588	0.4383	1
Onchocerca volvulus	Matrix metalloproteinase homolog	0.0105	0.0533	0.1215
Brugia malayi	GCC2 and GCC3 family protein	0.0192	0.1224	0.2792
Loa Loa (eye worm)	hypothetical protein	0.0588	0.4383	1
Schistosoma mansoni	peptidase Clp (S14 family)	0.0164	0.1007	0.2297
Loa Loa (eye worm)	hypothetical protein	0.0588	0.4383	1
Brugia malayi	EGF-like domain containing protein	0.019	0.1209	0.2759
Loa Loa (eye worm)	hypothetical protein	0.0588	0.4383	1
Loa Loa (eye worm)	Notch2	0.0192	0.1224	0.2792
Loa Loa (eye worm)	matrixin family protein	0.0115	0.0608	0.1388
Echinococcus granulosus	peptidase Clp S14 family	0.0108	0.0555	0.1265
Mycobacterium leprae	Probable fructose bisphosphate aldolase Fba	0.0702	0.53	0.53
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0152	0.0906	1
Echinococcus multilocularis	neural cadherin	0.019	0.1209	0.2759
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0049	0.0083	0.0189
Mycobacterium tuberculosis	Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP)	0.0108	0.0555	0.0555
Echinococcus multilocularis	protein jagged 1	0.019	0.1209	0.2759
Mycobacterium ulcerans	error-prone DNA polymerase	0.1285	0.9948	1
Loa Loa (eye worm)	notch protein	0.0192	0.1224	0.2792
Brugia malayi	Muscle positioning protein 4	0.0192	0.1224	0.2792
Schistosoma mansoni	hypothetical protein	0.019	0.1209	0.2759
Brugia malayi	Calcium binding EGF domain containing protein	0.0196	0.1261	0.2877
Onchocerca volvulus		0.019	0.1209	0.2759
Loa Loa (eye worm)	hypothetical protein	0.0588	0.4383	1
Mycobacterium ulcerans	flavin-containing monoamine oxidase AofH	0.0335	0.2365	0.2378
Wolbachia endosymbiont of Brugia malayi	DNA polymerase III alpha subunit	0.1285	0.9948	1
Brugia malayi	EGF-like domain containing protein	0.019	0.1209	0.2759
Echinococcus granulosus	fibropellin Ia	0.019	0.1209	0.2759
Onchocerca volvulus		0.0588	0.4383	1
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0072	0.0165
Loa Loa (eye worm)	hypothetical protein	0.0588	0.4383	1
Mycobacterium leprae	PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2)	0.0164	0.1007	0.1007
Plasmodium vivax	ATP-dependent Clp protease proteolytic subunit, putative	0.0057	0.0146	0.1455
Brugia malayi	Calcium binding EGF domain containing protein	0.0192	0.1224	0.2792
Onchocerca volvulus		0.019	0.1209	0.2759
Loa Loa (eye worm)	animal heme peroxidase	0.0588	0.4383	1
Loa Loa (eye worm)	hypothetical protein	0.0588	0.4383	1
Schistosoma mansoni	hypothetical protein	0.019	0.1209	0.2759
Treponema pallidum	ATP-dependent Clp protease proteolytic subunit	0.0164	0.1007	0.0878
Brugia malayi	hypothetical protein	0.0588	0.4383	1
Echinococcus granulosus	neurogenic locus protein delta	0.019	0.1209	0.2759
Mycobacterium leprae	PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP)	0.0108	0.0555	0.0555
Onchocerca volvulus		0.0192	0.1224	0.2792
Echinococcus granulosus	protein jagged 1	0.019	0.1209	0.2759
Toxoplasma gondii	ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein	0.0164	0.1007	0.8325
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0152	0.0906	0.5
Brugia malayi	hypothetical protein	0.0246	0.1655	0.3776
Trypanosoma brucei	hypothetical protein, conserved	0.0038	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0192	0.1224	0.2792
Loa Loa (eye worm)	hypothetical protein	0.019	0.1209	0.2759
Loa Loa (eye worm)	animal heme peroxidase	0.0588	0.4383	1
Loa Loa (eye worm)	matrix metalloproteinase	0.0047	0.0072	0.0165
Brugia malayi	Matrix metalloprotease, N-terminal domain containing protein	0.0058	0.0155	0.0353
Loa Loa (eye worm)	hypothetical protein	0.019	0.1209	0.2759
Echinococcus granulosus	Tolloid protein 1	0.0056	0.0138	0.0315
Echinococcus multilocularis	Tolloid protein 1	0.0056	0.0138	0.0315
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0152	0.0906	1
Onchocerca volvulus		0.019	0.1209	0.2759
Brugia malayi	Probable ClpP-like protease	0.0164	0.1007	0.2297
Brugia malayi	Matrixin family protein	0.0047	0.0072	0.0165
Onchocerca volvulus	Peroxidase homolog	0.0588	0.4383	1
Brugia malayi	Blistered cuticle protein 3	0.0588	0.4383	1
Schistosoma mansoni	cell polarity protein	0.019	0.1209	0.2759
Schistosoma mansoni	notch	0.019	0.1209	0.2759
Loa Loa (eye worm)	hypothetical protein	0.019	0.1209	0.2759
Loa Loa (eye worm)	hypothetical protein	0.019	0.1209	0.2759
Echinococcus multilocularis	neurogenic locus protein delta	0.019	0.1209	0.2759
Brugia malayi	Animal haem peroxidase family protein	0.0588	0.4383	1
Schistosoma mansoni	hypothetical protein	0.019	0.1209	0.2759
Echinococcus granulosus	neural cadherin	0.019	0.1209	0.2759
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0072	0.0165
Echinococcus multilocularis	slit 2 protein	0.019	0.1209	0.2759
Loa Loa (eye worm)	hypothetical protein	0.0058	0.0155	0.0353
Schistosoma mansoni	survival motor neuron protein	0.005	0.0094	0.0215
Loa Loa (eye worm)	hypothetical protein	0.0053	0.012	0.0274
Mycobacterium ulcerans	DNA polymerase III subunit alpha	0.1285	0.9948	1
Schistosoma mansoni	3-hydroxyacyl-CoA dehydrogenase	0.006	0.017	0.0388
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0049	0.0083	0.0189
Loa Loa (eye worm)	hypothetical protein	0.019	0.1209	0.2759
Loa Loa (eye worm)	blistered cuticle protein 3	0.0588	0.4383	1
Echinococcus multilocularis	notch	0.019	0.1209	0.2759
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0152	0.0906	1
Loa Loa (eye worm)	hypothetical protein	0.0588	0.4383	1
Brugia malayi	follicle stimulating hormone receptor	0.0243	0.1633	0.3726
Brugia malayi	Matrixin family protein	0.0047	0.0072	0.0165
Echinococcus granulosus	protein jagged 2	0.019	0.1209	0.2759
Loa Loa (eye worm)	hypothetical protein	0.0192	0.1224	0.2792
Plasmodium vivax	ATP-dependent Clp protease proteolytic subunit, putative	0.0164	0.1007	1
Schistosoma mansoni	hypothetical protein	0.019	0.1209	0.2759
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0152	0.0906	1
Onchocerca volvulus	Slit protein homolog	0.019	0.1209	0.2759
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.005	0.0094	0.0215
Brugia malayi	Animal haem peroxidase family protein	0.0588	0.4383	1
Echinococcus multilocularis	fat cadherin tumor suppressor	0.019	0.1209	0.2759
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0049	0.0083	0.0189
Loa Loa (eye worm)	hypothetical protein	0.0588	0.4383	1
Onchocerca volvulus	Neurogenic locus notch protein homolog	0.0192	0.1224	0.2792
Mycobacterium ulcerans	flavin-containing monoamine oxidase AofH	0.0335	0.2365	0.2378
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0049	0.0083	0.0189
Schistosoma mansoni	Pro-neuregulin-4 membrane-bound isoform (Pro-NRG4) [Contains: Neuregulin-4 (NRG-4)]	0.019	0.1209	0.2759
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0049	0.0083	0.0189
Toxoplasma gondii	ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein	0.0164	0.1007	0.8325
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.006	0.017	0.0171
Onchocerca volvulus		0.0047	0.0072	0.0165
Chlamydia trachomatis	DNA polymerase III subunit alpha	0.1285	0.9948	1
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0152	0.0906	0.5
Echinococcus multilocularis	peptidase Clp (S14 family)	0.0108	0.0555	0.1265
Mycobacterium leprae	PROBABLE HYDROLASE	0.0058	0.0155	0.0155
Loa Loa (eye worm)	hypothetical protein	0.0192	0.1224	0.2792
Onchocerca volvulus	Peroxidase homolog	0.0588	0.4383	1
Mycobacterium ulcerans	fructose-bisphosphate aldolase	0.0702	0.53	0.5328
Loa Loa (eye worm)	3-hydroxyacyl-CoA dehydrogenase type II	0.0056	0.0138	0.0315
Schistosoma mansoni	matrix metallopeptidase-9 (M10 family)	0.005	0.0093	0.0213
Brugia malayi	Calcium binding EGF domain containing protein	0.0192	0.1224	0.2792
Echinococcus granulosus	peroxidasin	0.0588	0.4383	1
Mycobacterium tuberculosis	Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2)	0.0108	0.0555	0.0555
Brugia malayi	notch-like transmembrane receptor	0.019	0.1209	0.2759
Echinococcus granulosus	matrix metallopeptidase 7 M10 family	0.0172	0.1069	0.2438
Brugia malayi	Peroxidasin	0.0588	0.4383	1
Loa Loa (eye worm)	hypothetical protein	0.019	0.1209	0.2759
Onchocerca volvulus	Neurogenic locus notch homolog	0.0192	0.1224	0.2792
Schistosoma mansoni	septate junction protein	0.019	0.1209	0.2759
Schistosoma mansoni	notch	0.019	0.1209	0.2759
Schistosoma mansoni	notch	0.0192	0.1224	0.2792
Loa Loa (eye worm)	hypothetical protein	0.0192	0.1224	0.2792
Schistosoma mansoni	notch	0.019	0.1209	0.2759
Brugia malayi	Matrixin family protein	0.0047	0.0072	0.0165
Onchocerca volvulus		0.0067	0.023	0.0525
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0243	0.1634	0.1634
Echinococcus granulosus	neurogenic locus notch protein	0.0192	0.1224	0.2792
Schistosoma mansoni	peroxidasin	0.0588	0.4383	1
Echinococcus multilocularis	matrix metallopeptidase 7 (M10 family)	0.0172	0.1069	0.2438
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0152	0.0906	1
Schistosoma mansoni	notch	0.019	0.1209	0.2759
Schistosoma mansoni	laminin gamma-3 chain	0.019	0.1209	0.2759
Mycobacterium ulcerans	ATP-dependent Clp protease proteolytic subunit	0.0164	0.1007	0.1012
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0072	0.0165
Loa Loa (eye worm)	hypothetical protein	0.019	0.1209	0.2759
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0152	0.0906	1
Echinococcus granulosus	neurogenic locus notch protein	0.019	0.1209	0.2759
Onchocerca volvulus		0.005	0.0094	0.0215
Giardia lamblia	High cysteine protein	0.019	0.1209	1
Mycobacterium leprae	ATP-dependent Clp protease proteolytic subunit 1	0.0057	0.0146	0.0146
Echinococcus multilocularis	protein jagged 2	0.019	0.1209	0.2759
Onchocerca volvulus		0.0588	0.4383	1
Mycobacterium tuberculosis	Probable peptidoglycan hydrolase	0.0058	0.0155	0.0155
Loa Loa (eye worm)	hypothetical protein	0.0588	0.4383	1
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0152	0.0906	1
Echinococcus granulosus	delta-like protein 1	0.019	0.1209	0.2759
Loa Loa (eye worm)	hypothetical protein	0.019	0.1209	0.2759
Trypanosoma cruzi	hypothetical protein, conserved	0.0038	0	0.5
Mycobacterium ulcerans	hypothetical protein	0.0243	0.1634	0.1642
Mycobacterium tuberculosis	Probable DNA polymerase III (alpha chain) DnaE2 (DNA nucleotidyltransferase)	0.1291	1	1
Echinococcus granulosus	protein jagged 2	0.019	0.1209	0.2759
Toxoplasma gondii	EGF family domain-containing protein	0.019	0.1209	1
Onchocerca volvulus	Matrilysin homolog	0.0105	0.0533	0.1215
Loa Loa (eye worm)	animal heme peroxidase	0.0588	0.4383	1
Loa Loa (eye worm)	hypothetical protein	0.0588	0.4383	1
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.006	0.017	0.0171
Echinococcus multilocularis	3 hydroxyacyl coenzyme A dehydrogenase type 2	0.006	0.017	0.0388
Schistosoma mansoni	hypothetical protein	0.019	0.1209	0.2759
Onchocerca volvulus	Chorion peroxidase homolog	0.0588	0.4383	1
Schistosoma mansoni	hypothetical protein	0.019	0.1209	0.2759
Brugia malayi	Animal haem peroxidase family protein	0.0588	0.4383	1
Brugia malayi	Matrixin family protein	0.0115	0.0608	0.1388
Mycobacterium ulcerans	hydrolase	0.0058	0.0155	0.0156
Toxoplasma gondii	hypothetical protein	0.0057	0.0146	0.1211
Brugia malayi	3-hydroxyacyl-CoA dehydrogenase type II	0.006	0.017	0.0388
Loa Loa (eye worm)	hypothetical protein	0.0246	0.1655	0.3776
Loa Loa (eye worm)	bone morphogenetic protein 1b	0.0056	0.0138	0.0315
Loa Loa (eye worm)	hypothetical protein	0.0164	0.1007	0.2297
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0049	0.0083	0.0189
Schistosoma mansoni	notch	0.019	0.1209	0.2759
Loa Loa (eye worm)	hypothetical protein	0.0588	0.4383	1
Echinococcus multilocularis	neurogenic locus notch protein 4	0.019	0.1209	0.2759
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0245	0.1647	0.1647
Schistosoma mansoni	matrix metallopeptidase-7 (M10 family)	0.0047	0.0072	0.0165
Echinococcus granulosus	notch	0.019	0.1209	0.2759
Schistosoma mansoni	hypothetical protein	0.0067	0.023	0.0525
Brugia malayi	EGF-like domain containing protein	0.019	0.1209	0.2759
Leishmania major	3-oxoacyl-(acyl-carrier protein) reductase, putative	0.006	0.017	1
Mycobacterium ulcerans	ATP-dependent Clp protease proteolytic subunit	0.0164	0.1007	0.1012
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0243	0.1633	0.3726
Loa Loa (eye worm)	hypothetical protein	0.019	0.1209	0.2759
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0049	0.0083	0.0189
Brugia malayi	EGF-like domain containing protein	0.019	0.1209	0.2759
Loa Loa (eye worm)	matrixin family protein	0.0105	0.0533	0.1215
Mycobacterium tuberculosis	Probable fructose-bisphosphate aldolase Fba	0.0702	0.53	0.53
Schistosoma mansoni	peroxidasin	0.0588	0.4383	1
Loa Loa (eye worm)	hypothetical protein	0.019	0.1209	0.2759
Onchocerca volvulus		0.0588	0.4383	1
Brugia malayi	EGF-like domain containing protein	0.019	0.1209	0.2759
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.006	0.017	0.017
Treponema pallidum	DNA polymerase III subunit alpha	0.1285	0.9948	1
Brugia malayi	EGF-like domain containing protein	0.019	0.1209	0.2759
Echinococcus granulosus	survival motor neuron protein 1	0.0246	0.1655	0.3776
Echinococcus granulosus	slit 2 protein	0.019	0.1209	0.2759
Brugia malayi	Cadherin domain containing protein	0.019	0.1209	0.2759
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0049	0.0083	0.0189
Echinococcus granulosus	ATP dependent Clp protease proteolytic subunit	0.0164	0.1007	0.2297
Mycobacterium tuberculosis	Probable DNA polymerase III (alpha chain) DnaE1 (DNA nucleotidyltransferase)	0.1291	1	1
Brugia malayi	EGF-like domain containing protein	0.019	0.1209	0.2759
Onchocerca volvulus	Matrilysin homolog	0.0047	0.0072	0.0165
Loa Loa (eye worm)	hypothetical protein	0.019	0.1209	0.2759

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 7.215	Inhibition of human recombinant MMP2 by colorimetric analysis	ChEMBL.	27452283
IC50 (binding)	= 0.4 nM	Inhibition of human recombinant MMP2 by colorimetric analysis	ChEMBL.	27452283

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: CHEMBL3827377

Bibliographic References

1 literature reference was collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.

Detailed information for compound 2199349