TDR Targets

Basic information

Technical information

TDR Targets ID: 1152135
Name: 3-methyl-7,8,9,10-tetrahydro-6H-azepino[2,1-b ]quinazolin-12-one
MW: 228.29 | Formula: C14H16N2O
H donors: 0 H acceptors: 1 LogP: 2.02 Rotable bonds: 0
Rule of 5 violations (Lipinski): 1
SMILES: Cc1ccc2c(c1)nc1n(c2=O)CCCCC1
InChi: 1S/C14H16N2O/c1-10-6-7-11-12(9-10)15-13-5-3-2-4-8-16(13)14(11)17/h6-7,9H,2-5,8H2,1H3
InChiKey: PRDLUXCOTPJFJA-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

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
Brugia malayi	Calcium binding EGF domain containing protein	0.004	0.0222	0.0342
Loa Loa (eye worm)	hypothetical protein	0.004	0.0222	0.0342
Brugia malayi	RNA binding protein	0.0061	0.0504	0.0775
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0023	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0228	0.2703	0.4161
Brugia malayi	Cadherin domain containing protein	0.0031	0.0112	0.0173
Brugia malayi	Transmembrane cell adhesion receptor mua-3 precursor, putative	0.0031	0.0112	0.0173
Toxoplasma gondii	PAN/Apple domain-containing protein	0.0061	0.0501	0.0986
Echinococcus multilocularis	neurogenic locus notch protein	0.0031	0.0112	0.00000002142
Onchocerca volvulus		0.0517	0.6496	1
Echinococcus multilocularis	glycoprotein Antigen 5	0.0082	0.0779	0.0674
Echinococcus granulosus	tar DNA binding protein	0.0061	0.0504	0.0468
Echinococcus granulosus	neurogenic locus notch protein	0.0031	0.0112	0.000000025355
Brugia malayi	Calcium binding EGF domain containing protein	0.0031	0.0112	0.0173
Schistosoma mansoni	cercarial elastase (S01 family)	0.0082	0.0779	0.0798
Echinococcus granulosus	Mastin	0.0082	0.0779	0.0798
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0112	0.0173
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0112	0.0173
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0112	0.0173
Echinococcus granulosus	microtubule associated protein 2	0.0667	0.8465	1
Echinococcus granulosus	survival motor neuron protein 1	0.0228	0.2703	0.3101
Echinococcus granulosus	neuropeptide receptor A26	0.0447	0.5573	0.6538
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0501	0.0771
Schistosoma mansoni	cercarial elastase (S01 family)	0.0082	0.0779	0.0798
Brugia malayi	RNA recognition motif domain containing protein	0.0061	0.0504	0.0775
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0501	0.0771
Echinococcus multilocularis	fibrillin 1	0.004	0.0222	0.0111
Brugia malayi	PAN domain containing protein	0.0061	0.0501	0.0771
Toxoplasma gondii	PAN domain-containing protein	0.0061	0.0501	0.0986
Loa Loa (eye worm)	multiple epidermal growth factor-like domains 6	0.004	0.0222	0.0342
Brugia malayi	PAN domain containing protein	0.0061	0.0501	0.0771
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0082	0.0779	0.0798
Schistosoma mansoni	aminopeptidase PILS (M01 family)	0.0082	0.0779	0.0798
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0112	0.0173
Schistosoma mansoni	cercarial elastase (S01 family)	0.0082	0.0779	0.0798
Loa Loa (eye worm)	hypothetical protein	0.0082	0.0779	0.12
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.0047	0.0312	0.048
Echinococcus multilocularis	neuropeptide s receptor	0.0447	0.5573	0.5523
Brugia malayi	hypothetical protein	0.0228	0.2703	0.4161
Echinococcus granulosus	Tolloid protein 1	0.004	0.0222	0.0131
Toxoplasma gondii	microneme protein MIC17C	0.0061	0.0501	0.0986
Brugia malayi	EGF-like domain containing protein	0.0031	0.0112	0.0173
Toxoplasma gondii	hypothetical protein	0.0061	0.0501	0.0986
Onchocerca volvulus		0.0061	0.0501	0.0771
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0112	0.0173
Plasmodium falciparum	cysteine repeat modular protein 1	0.024	0.2858	0.5
Entamoeba histolytica	hypothetical protein	0.0035	0.0156	1
Schistosoma mansoni	egf-like domain protein	0.004	0.0222	0.0131
Loa Loa (eye worm)	hypothetical protein	0.004	0.0222	0.0342
Schistosoma mansoni	cercarial elastase (S01 family)	0.0082	0.0779	0.0798
Schistosoma mansoni	tar DNA-binding protein	0.0061	0.0504	0.0468
Loa Loa (eye worm)	trypsin family protein	0.0082	0.0779	0.12
Echinococcus granulosus	neuropeptide s receptor	0.0447	0.5573	0.6538
Echinococcus granulosus	enteropeptidase	0.0082	0.0779	0.0798
Brugia malayi	hypothetical protein	0.0082	0.0779	0.12
Brugia malayi	Trypsin family protein	0.0082	0.0779	0.12
Echinococcus multilocularis	subfamily S1A unassigned peptidase (S01 family)	0.0082	0.0779	0.0674
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0112	0.0173
Schistosoma mansoni	tar DNA-binding protein	0.0061	0.0504	0.0468
Onchocerca volvulus		0.0031	0.0112	0.0173
Brugia malayi	EGF-like domain containing protein	0.0031	0.0112	0.0173
Loa Loa (eye worm)	PAN domain-containing protein	0.0061	0.0501	0.0771
Loa Loa (eye worm)	hypothetical protein	0.0082	0.0779	0.12
Schistosoma mansoni	hypothetical protein	0.0082	0.0779	0.0798
Onchocerca volvulus		0.0082	0.0779	0.12
Loa Loa (eye worm)	TK/ROR protein kinase	0.024	0.2858	0.44
Toxoplasma gondii	microneme protein MIC4	0.0061	0.0501	0.0986
Schistosoma mansoni	microtubule-associated protein tau	0.0667	0.8465	1
Onchocerca volvulus		0.0082	0.0779	0.12
Onchocerca volvulus		0.0082	0.0779	0.12
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0061	0.0504	0.0775
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0082	0.0779	0.0798
Loa Loa (eye worm)	PAN domain-containing protein	0.0061	0.0501	0.0771
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0517	0.6496	0.7642
Brugia malayi	Cadherin domain containing protein	0.0031	0.0112	0.0173
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0112	0.0173
Schistosoma mansoni	tar DNA-binding protein	0.0061	0.0504	0.0468
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0501	0.0771
Echinococcus granulosus	Peptidase S1 S6 chymotrypsin Hap	0.0082	0.0779	0.0798
Toxoplasma gondii	hypothetical protein	0.0061	0.0501	0.0986
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0112	0.0173
Brugia malayi	hypothetical protein	0.0035	0.0156	0.024
Onchocerca volvulus		0.0435	0.5415	0.8337
Loa Loa (eye worm)	hypothetical protein	0.004	0.0222	0.0342
Onchocerca volvulus		0.0061	0.0501	0.0771
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0112	0.0173
Onchocerca volvulus		0.0031	0.0112	0.0173
Schistosoma mansoni	transcription factor LCR-F1	0.0035	0.0156	0.0052
Onchocerca volvulus		0.024	0.2858	0.44
Brugia malayi	EGF-like domain containing protein	0.0031	0.0112	0.0173
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0501	0.0771
Toxoplasma gondii	microneme protein MIC17A	0.0061	0.0501	0.0986
Toxoplasma gondii	calcium binding egf domain-containing protein	0.004	0.0222	0.0278
Brugia malayi	EGF-like domain containing protein	0.0031	0.0112	0.0173
Echinococcus multilocularis	transmembrane protease serine 3	0.0082	0.0779	0.0674
Loa Loa (eye worm)	hypothetical protein	0.0082	0.0779	0.12
Brugia malayi	EGF-like domain containing protein	0.0031	0.0112	0.0173
Onchocerca volvulus		0.0061	0.0501	0.0771
Toxoplasma gondii	PAN domain-containing protein	0.0331	0.4052	1
Echinococcus granulosus	subfamily S1A unassigned peptidase S01 family	0.0082	0.0779	0.0798
Brugia malayi	PAN domain containing protein	0.0061	0.0501	0.0771
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0023	0	0.5
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0023	0	0.5
Toxoplasma gondii	microneme protein, putative	0.0061	0.0501	0.0986
Toxoplasma gondii	1,3(4)-beta-glucanase	0.0061	0.0501	0.0986
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0501	0.0771
Toxoplasma gondii	PAN domain-containing protein	0.0061	0.0501	0.0986
Brugia malayi	PAN domain containing protein	0.0061	0.0501	0.0771
Echinococcus multilocularis	Mastin	0.0082	0.0779	0.0674
Entamoeba histolytica	hypothetical protein	0.0035	0.0156	1
Echinococcus multilocularis	enteropeptidase	0.0082	0.0779	0.0674
Echinococcus granulosus	laminin	0.004	0.0222	0.0131
Onchocerca volvulus	Slit protein homolog	0.0031	0.0112	0.0173
Loa Loa (eye worm)	bone morphogenetic protein 1b	0.004	0.0222	0.0342
Onchocerca volvulus		0.0031	0.0112	0.0173
Onchocerca volvulus		0.0061	0.0501	0.0771
Entamoeba histolytica	hypothetical protein	0.0035	0.0156	1
Schistosoma mansoni	cercarial elastase (S01 family)	0.0082	0.0779	0.0798
Toxoplasma gondii	calcium binding egf domain-containing protein	0.004	0.0222	0.0278
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0023	0	0.5
Toxoplasma gondii	PAN domain-containing protein	0.0331	0.4052	1
Loa Loa (eye worm)	low-density lipoprotein receptor repeat class B containing protein	0.004	0.0222	0.0342
Brugia malayi	EGF-like domain containing protein	0.0031	0.0112	0.0173
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0112	0.0173
Echinococcus multilocularis	tar DNA binding protein	0.0061	0.0504	0.0396
Onchocerca volvulus		0.0082	0.0779	0.12
Toxoplasma gondii	kringle domain-containing protein	0.024	0.2858	0.697
Onchocerca volvulus		0.0061	0.0501	0.0771
Leishmania major	hypothetical protein, conserved	0.024	0.2858	1
Schistosoma mansoni	cercarial elastase (S01 family)	0.0082	0.0779	0.0798
Brugia malayi	Chymotrypsin-like protease CTRL-1 precursor	0.0082	0.0779	0.12
Brugia malayi	Trypsin family protein	0.0082	0.0779	0.12
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0112	0.0173
Onchocerca volvulus		0.0031	0.0112	0.0173
Brugia malayi	TAR-binding protein	0.0061	0.0504	0.0775
Onchocerca volvulus	Arrow homolog	0.004	0.0222	0.0342
Schistosoma mansoni	hypothetical protein	0.024	0.2858	0.3287
Schistosoma mansoni	hypothetical protein	0.0082	0.0779	0.0798
Entamoeba histolytica	hypothetical protein	0.0035	0.0156	1
Loa Loa (eye worm)	hypothetical protein	0.004	0.0222	0.0342
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0501	0.0771
Echinococcus multilocularis	Peptidase S1 S6, chymotrypsin Hap	0.0082	0.0779	0.0674
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0112	0.0173
Brugia malayi	PAN domain containing protein	0.0061	0.0501	0.0771
Echinococcus granulosus	glycoprotein Antigen 5	0.0082	0.0779	0.0798
Brugia malayi	Kringle domain containing protein	0.024	0.2858	0.44
Loa Loa (eye worm)	hypothetical protein	0.0517	0.6496	1
Loa Loa (eye worm)	hypothetical protein	0.0082	0.0779	0.12
Echinococcus multilocularis	Tolloid protein 1	0.004	0.0222	0.0111
Brugia malayi	PAN domain containing protein	0.0061	0.0501	0.0771
Echinococcus multilocularis	survival motor neuron protein 1	0.0228	0.2703	0.262
Onchocerca volvulus		0.0047	0.0312	0.048
Schistosoma mansoni	hypothetical protein	0.0035	0.0156	0.0052
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0501	0.0771
Onchocerca volvulus	Neurogenic locus notch homolog	0.0031	0.0112	0.0173
Schistosoma mansoni	cercarial elastase (S01 family)	0.0082	0.0779	0.0798
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0035	0.0156	0.0052
Brugia malayi	Trypsin family protein	0.0082	0.0779	0.12
Brugia malayi	notch-like transmembrane receptor	0.0031	0.0112	0.0173
Giardia lamblia	High cysteine protein	0.0031	0.0112	0.5
Schistosoma mansoni	cercarial elastase (S01 family)	0.0082	0.0779	0.0798
Schistosoma mansoni	hypothetical protein	0.0047	0.0312	0.0238
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0112	0.0173
Onchocerca volvulus	Putative cubilin	0.0031	0.0112	0.0173
Brugia malayi	Trypsin-like protease protein 5	0.0082	0.0779	0.12
Toxoplasma gondii	PAN domain-containing protein	0.0061	0.0501	0.0986
Brugia malayi	Calcium binding EGF domain containing protein	0.0031	0.0112	0.0173
Brugia malayi	Calcium binding EGF domain containing protein	0.0031	0.0112	0.0173
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0112	0.0173
Brugia malayi	Fibulin-1 precursor	0.004	0.0222	0.0342
Loa Loa (eye worm)	notch protein	0.0031	0.0112	0.0173
Onchocerca volvulus		0.0061	0.0501	0.0771
Onchocerca volvulus		0.0061	0.0501	0.0771
Schistosoma mansoni	cercarial elastase (S01 family)	0.0082	0.0779	0.0798
Echinococcus multilocularis	laminin	0.004	0.0222	0.0111
Loa Loa (eye worm)	PAN domain-containing protein	0.0061	0.0501	0.0771
Echinococcus multilocularis	tissue type plasminogen activator	0.024	0.2858	0.2777
Onchocerca volvulus		0.0061	0.0501	0.0771
Schistosoma mansoni	tar DNA-binding protein	0.0061	0.0504	0.0468
Brugia malayi	Muscle positioning protein 4	0.0031	0.0112	0.0173
Brugia malayi	GCC2 and GCC3 family protein	0.0031	0.0112	0.0173
Toxoplasma gondii	subtilisin SUB12	0.0061	0.0501	0.0986
Echinococcus multilocularis	neuropeptide receptor A26	0.0447	0.5573	0.5523
Brugia malayi	PAN domain containing protein	0.0061	0.0501	0.0771
Onchocerca volvulus		0.0082	0.0779	0.12
Echinococcus multilocularis	microtubule associated protein 2	0.0667	0.8465	0.8448
Brugia malayi	Low-density lipoprotein receptor repeat class B containing protein	0.004	0.0222	0.0342
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0112	0.0173
Schistosoma mansoni	cercarial elastase (S01 family)	0.0082	0.0779	0.0798
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0112	0.0173
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0112	0.0173
Loa Loa (eye worm)	hypothetical protein	0.0517	0.6496	1
Brugia malayi	Trypsin family protein	0.0517	0.6496	1
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0112	0.0173
Schistosoma mansoni	cercarial elastase (S01 family)	0.0082	0.0779	0.0798
Brugia malayi	PAN domain containing protein	0.0061	0.0501	0.0771
Loa Loa (eye worm)	hypothetical protein	0.024	0.2858	0.44
Loa Loa (eye worm)	RNA binding protein	0.0061	0.0504	0.0775
Toxoplasma gondii	microneme protein MIC17B	0.0061	0.0501	0.0986
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0082	0.0779	0.0798
Onchocerca volvulus	Neurogenic locus notch protein homolog	0.0031	0.0112	0.0173
Loa Loa (eye worm)	hypothetical protein	0.004	0.0222	0.0342
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0112	0.0173
Schistosoma mansoni	tar DNA-binding protein	0.0061	0.0504	0.0468
Toxoplasma gondii	PAN domain-containing protein	0.0061	0.0501	0.0986
Echinococcus granulosus	transmembrane protease serine 3	0.0082	0.0779	0.0798
Schistosoma mansoni	survival motor neuron protein	0.0047	0.0312	0.0238
Echinococcus granulosus	tissue type plasminogen activator	0.024	0.2858	0.3287
Brugia malayi	PAN domain containing protein	0.0061	0.0501	0.0771
Loa Loa (eye worm)	Notch2	0.0031	0.0112	0.0173
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0082	0.0779	0.0798
Onchocerca volvulus		0.0061	0.0501	0.0771
Onchocerca volvulus		0.0061	0.0501	0.0771
Trypanosoma cruzi	hypothetical protein, conserved	0.024	0.2858	0.5
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0035	0.0156	0.0044
Brugia malayi	PAN domain containing protein	0.0061	0.0501	0.0771
Brugia malayi	Delta serrate ligand family protein	0.0031	0.0112	0.0173
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0112	0.0173
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0112	0.0173
Plasmodium vivax	cysteine repeat modular protein 1, putative	0.024	0.2858	0.5
Onchocerca volvulus		0.0031	0.0112	0.0173
Loa Loa (eye worm)	PAN domain-containing protein	0.0061	0.0501	0.0771
Loa Loa (eye worm)	TAR-binding protein	0.0061	0.0504	0.0775
Mycobacterium ulcerans	hypothetical protein	0.0082	0.0779	1
Loa Loa (eye worm)	PAN domain-containing protein	0.0061	0.0501	0.0771
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0112	0.0173
Brugia malayi	EGF-like domain containing protein	0.0031	0.0112	0.0173
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0517	0.6496	0.7642
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0082	0.0779	0.0798
Schistosoma mansoni	subfamily M12A unassigned peptidase (M12 family)	0.004	0.0222	0.0131
Brugia malayi	Protein kinase domain containing protein	0.024	0.2858	0.44
Loa Loa (eye worm)	hypothetical protein	0.0082	0.0779	0.12
Onchocerca volvulus		0.0061	0.0501	0.0771

Activities

No activities found for this compound.

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: CHEMBL1193725

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 1152135