TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 240.085 | Formula: C11H7Cl2NO
H donors: 0 H acceptors: 1 LogP: 2.92 Rotable bonds: 1
Rule of 5 violations (Lipinski): 1
SMILES: Clc1ccc(=O)n(c1)c1cccc(c1)Cl
InChi: 1S/C11H7Cl2NO/c12-8-2-1-3-10(6-8)14-7-9(13)4-5-11(14)15/h1-7H
InChiKey: RPQVCLCAWZLJSF-UHFFFAOYSA-N

Network

Hover on a compound node to display the structore

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

This is a work in progress. Come back soon to try this features!

Clustering layers

This is a work in progress. Come back soon to try this features!

Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

No curated genes were found associated with this compound

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	0.0255	0.321	1
Schistosoma mansoni	fusion	0.0255	0.321	0.3133
Leishmania major	hypothetical protein, conserved	0.0255	0.321	1
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0093	0.0827	1
Trypanosoma cruzi	hypothetical protein, conserved	0.0255	0.321	1
Schistosoma mansoni	hypothetical protein	0.0717	1	1
Trypanosoma brucei	Zn-finger in Ran binding protein and others/FYVE zinc finger, putative	0.0255	0.321	1
Loa Loa (eye worm)	hypothetical protein	0.0427	0.5732	0.5732
Schistosoma mansoni	gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2	0.014	0.1516	0.1419
Echinococcus granulosus	histone acetyltransferase KAT2B	0.0041	0.0065	0.0058
Mycobacterium tuberculosis	Putative ferredoxin reductase	0.0084	0.069	0.8342
Schistosoma mansoni	tar DNA-binding protein	0.0071	0.05	0.0392
Echinococcus granulosus	zinc finger protein Ran binding	0.0255	0.321	0.3205
Echinococcus multilocularis	ring and YY1 binding protein	0.0255	0.321	0.3205
Onchocerca volvulus		0.0255	0.321	0.2543
Toxoplasma gondii	ran binding protein	0.0255	0.321	0.321
Loa Loa (eye worm)	hypothetical protein	0.0255	0.321	0.321
Toxoplasma gondii	DNA topoisomerase domain-containing protein	0.0717	1	1
Brugia malayi	Zn-finger in Ran binding protein and others containing protein	0.0255	0.321	0.321
Brugia malayi	brahma associated protein 60 kDa	0.0717	1	1
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0044	0.0113	0.0106
Trypanosoma brucei	mitochondrial RNA binding complex 1 subunit	0.0255	0.321	1
Loa Loa (eye worm)	brahma associated protein	0.0717	1	1
Loa Loa (eye worm)	hypothetical protein	0.0401	0.5355	0.5355
Schistosoma mansoni	zinc finger protein	0.0255	0.321	0.3133
Loa Loa (eye worm)	TAR-binding protein	0.0071	0.05	0.05
Loa Loa (eye worm)	hypothetical protein	0.0097	0.0895	0.0895
Leishmania major	hypothetical protein, conserved	0.0255	0.321	1
Schistosoma mansoni	tar DNA-binding protein	0.0071	0.05	0.0392
Mycobacterium tuberculosis	Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB	0.0084	0.069	0.8342
Echinococcus granulosus	Two pore potassium channel protein sup 9	0.0427	0.5732	0.5729
Trypanosoma cruzi	WLM domain containing protein, putative	0.0255	0.321	1
Plasmodium vivax	SWIB/MDM2 domain-containing protein, putative	0.0717	1	1
Toxoplasma gondii	Zn-finger in Ran binding protein and others domain-containing protein	0.0255	0.321	0.321
Trypanosoma cruzi	Zn-finger in Ran binding protein and others, putative	0.0255	0.321	1
Loa Loa (eye worm)	acetyltransferase	0.014	0.1516	0.1516
Onchocerca volvulus		0.0255	0.321	0.2543
Echinococcus granulosus	Nuclear pore complex protein Nup153	0.0255	0.321	0.3205
Giardia lamblia	Histone acetyltransferase GCN5	0.0038	0.0015	0.5
Toxoplasma gondii	SWIB/MDM2 domain-containing protein	0.0717	1	1
Brugia malayi	Twik (KCNK-like) family of potassium channels, alpha subunit 38. C. elegans sup-9 ortholog	0.0427	0.5732	0.5732
Plasmodium vivax	hypothetical protein, conserved	0.0717	1	1
Brugia malayi	Zn-finger in Ran binding protein and others containing protein	0.0255	0.321	0.321
Trypanosoma brucei	hypothetical protein, conserved	0.0255	0.321	1
Trypanosoma cruzi	Zn-finger in Ran binding protein and others, putative	0.0255	0.321	1
Echinococcus granulosus	geminin	0.0189	0.2241	0.2235
Plasmodium falciparum	histone acetyltransferase GCN5	0.0038	0.0015	0.0015
Schistosoma mansoni	hypothetical protein	0.0189	0.2241	0.2153
Loa Loa (eye worm)	hypothetical protein	0.0427	0.5732	0.5732
Schistosoma mansoni	brg-1 associated factor	0.0717	1	1
Loa Loa (eye worm)	SWIB/MDM2 domain-containing protein	0.0717	1	1
Schistosoma mansoni	hypothetical protein	0.0717	1	1
Loa Loa (eye worm)	hypothetical protein	0.0255	0.321	0.321
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0044	0.0113	0.0113
Schistosoma mansoni	TRABID protein (C64 family)	0.0255	0.321	0.3133
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.0093	0.0827	1
Schistosoma mansoni	tar DNA-binding protein	0.0071	0.05	0.0392
Loa Loa (eye worm)	hypothetical protein	0.0255	0.321	0.321
Echinococcus multilocularis	Zinc finger, RanBP2 type	0.0255	0.321	0.3205
Echinococcus multilocularis	Upstream activation factor subunit UAF30	0.0717	1	1
Schistosoma mansoni	twik family of potassium channels-related	0.0427	0.5732	0.5683
Echinococcus multilocularis	Two pore potassium channel protein sup 9	0.0427	0.5732	0.5729
Echinococcus granulosus	histone acetyltransferase KAT2B	0.0136	0.1458	0.1452
Brugia malayi	Zn-finger in Ran binding protein and others containing protein	0.0255	0.321	0.321
Onchocerca volvulus	Ubiquitin thioesterase ZRANB1 homolog	0.0255	0.321	0.2543
Mycobacterium tuberculosis	Probable dehydrogenase	0.0084	0.069	0.8342
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0044	0.0113	0.0106
Loa Loa (eye worm)	hypothetical protein	0.0255	0.321	0.321
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0071	0.05	0.05
Trypanosoma cruzi	Zn-finger in Ran binding protein and others/FYVE zinc finger, putative	0.0255	0.321	1
Entamoeba histolytica	acetyltransferase, GNAT family	0.0038	0.0015	0.5
Schistosoma mansoni	cellular tumor antigen P53	0.0097	0.0895	0.0791
Onchocerca volvulus		0.0255	0.321	0.2543
Echinococcus multilocularis	Nuclear pore complex protein Nup153	0.0255	0.321	0.3205
Onchocerca volvulus		0.0717	1	1
Brugia malayi	Zn-finger in Ran binding protein and others containing protein	0.0255	0.321	0.321
Plasmodium falciparum	SWIB/MDM2 domain-containing protein	0.0717	1	1
Trypanosoma brucei	hypothetical protein, conserved	0.0255	0.321	1
Onchocerca volvulus		0.0255	0.321	0.2543
Plasmodium falciparum	zinc finger Ran-binding domain-containing protein 2, putative	0.0255	0.321	0.321
Brugia malayi	TAR-binding protein	0.0071	0.05	0.05
Echinococcus granulosus	tumor protein p63	0.0666	0.9254	0.9253
Echinococcus multilocularis	tumor protein p63	0.0666	0.9254	0.9253
Schistosoma mansoni	RNA binding protein	0.0255	0.321	0.3133
Brugia malayi	RNA recognition motif domain containing protein	0.0071	0.05	0.05
Echinococcus multilocularis	gcn5proteinral control of amino acid synthesis	0.014	0.1516	0.151
Schistosoma mansoni	hypothetical protein	0.0717	1	1
Echinococcus multilocularis	SWI:SNF matrix associated	0.0717	1	1
Leishmania major	hypothetical protein, conserved	0.0255	0.321	1
Echinococcus granulosus	ring and YY1 binding protein	0.0255	0.321	0.3205
Echinococcus multilocularis	SWI:SNF matrix associated	0.0717	1	1
Mycobacterium tuberculosis	Probable oxidoreductase	0.0093	0.0827	1
Echinococcus granulosus	SWI:SNF matrix associated	0.0717	1	1
Echinococcus granulosus	tar DNA binding protein	0.0071	0.05	0.0494
Loa Loa (eye worm)	hypothetical protein	0.0255	0.321	0.321
Schistosoma mansoni	hypothetical protein	0.0189	0.2241	0.2153
Mycobacterium tuberculosis	Probable membrane NADH dehydrogenase NdhA	0.0084	0.069	0.8342
Schistosoma mansoni	tar DNA-binding protein	0.0071	0.05	0.0392
Leishmania major	hypothetical protein, conserved	0.0255	0.321	1
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0044	0.0113	0.0106
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0044	0.0113	0.0106
Brugia malayi	RNA binding protein	0.0071	0.05	0.05
Trypanosoma cruzi	mitochondrial RNA binding complex 1 subunit, putative	0.0255	0.321	1
Toxoplasma gondii	histone lysine acetyltransferase GCN5-A	0.0041	0.0065	0.0065
Trypanosoma cruzi	hypothetical protein, conserved	0.0255	0.321	1
Plasmodium falciparum	SWIB/MDM2 domain-containing protein	0.0717	1	1
Brugia malayi	SWIB/MDM2 domain containing protein	0.0717	1	1
Echinococcus granulosus	Zinc finger RanBP2 type	0.0255	0.321	0.3205
Trichomonas vaginalis	conserved hypothetical protein	0.0717	1	1
Toxoplasma gondii	histone lysine acetyltransferase GCN5-B	0.0041	0.0065	0.0065
Plasmodium vivax	histone acetyltransferase GCN5, putative	0.0041	0.0065	0.0065
Echinococcus multilocularis	geminin	0.0189	0.2241	0.2235
Brugia malayi	acetyltransferase, GNAT family protein	0.014	0.1516	0.1516
Schistosoma mansoni	tar DNA-binding protein	0.0071	0.05	0.0392
Trypanosoma cruzi	WLM domain containing protein, putative	0.0255	0.321	1
Mycobacterium tuberculosis	Probable reductase	0.0084	0.069	0.8342
Mycobacterium tuberculosis	Probable NADH dehydrogenase Ndh	0.0084	0.069	0.8342
Leishmania major	hypothetical protein, conserved	0.0255	0.321	1
Trypanosoma cruzi	mitochondrial RNA binding complex 1 subunit, putative	0.0255	0.321	1
Echinococcus multilocularis	zinc finger protein Ran binding	0.0255	0.321	0.3205
Loa Loa (eye worm)	RNA binding protein	0.0071	0.05	0.05
Chlamydia trachomatis	SWIB complex protein	0.0717	1	0.5
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0044	0.0113	0.0113
Echinococcus granulosus	Upstream activation factor subunit UAF30	0.0717	1	1
Echinococcus multilocularis	SWI:SNF matrix associated	0.0717	1	1
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.0093	0.0827	1
Brugia malayi	YY1-associated factor 2	0.0255	0.321	0.321
Schistosoma mansoni	hypothetical protein	0.0255	0.321	0.3133
Echinococcus multilocularis	tar DNA binding protein	0.0071	0.05	0.0494
Chlamydia trachomatis	DNA topoisomerase I	0.0717	1	0.5

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	= 0.8 mM	Anti-fibrosis activity in mouse NIH/3T3 cells assessed as inhibition of proliferation after 72 hrs by MTT assay	ChEMBL.	22342629

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: CHEMBL1957117

Bibliographic References

No literature references available for this target.

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

Detailed information for compound 1623235