TDR Targets

Basic information

Technical information

TDR Targets ID: 224781
Name: methyl 2-(2,2-diphenylacetyl)-5-[(4-methoxyph enyl)methyl]-3,4-dihydro-1H-isoquinoline-3-ca rboxylate
MW: 505.604 | Formula: C33H31NO4
H donors: 0 H acceptors: 2 LogP: 6.39 Rotable bonds: 9
Rule of 5 violations (Lipinski): 2
SMILES: COC(=O)C1Cc2c(CN1C(=O)C(c1ccccc1)c1ccccc1)cccc2Cc1ccc(cc1)OC
InChi: 1S/C33H31NO4/c1-37-28-18-16-23(17-19-28)20-26-14-9-15-27-22-34(30(21-29(26)27)33(36)38-2)32(35)31(24-10-5-3-6-11-24)25-12-7-4-8-13-25/h3-19,30-31H,20-22H2,1-2H3
InChiKey: RANSNVVVJGRXFI-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

5-[(4-methoxyphenyl)methyl]-2-(1-oxo-2,2-diphenylethyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester
methyl 2-(2,2-diphenylethanoyl)-5-[(4-methoxyphenyl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate
2-(2,2-diphenylacetyl)-5-p-anisyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester
methyl 2-[2,2-di(phenyl)acetyl]-5-[(4-methoxyphenyl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate
5-[(4-methoxyphenyl)methyl]-2-[1-oxo-2,2-di(phenyl)ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester
2-[2,2-di(phenyl)acetyl]-5-(4-methoxybenzyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester
methyl 2-[2,2-di(phenyl)ethanoyl]-5-[(4-methoxyphenyl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Rattus norvegicus	Angiotensin II receptor (AT-1) type-1	Starlite/ChEMBL	References
Rattus norvegicus	Angiotensin II type 2 (AT-2) receptor	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

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Onchocerca volvulus		Angiotensin II receptor (AT-1) type-1	359 aa	355 aa	23.9 %
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	Angiotensin II type 2 (AT-2) receptor	363 aa	398 aa	18.3 %
Schistosoma mansoni	opsin-like receptor	Angiotensin II receptor (AT-1) type-1	359 aa	299 aa	25.8 %
Loa Loa (eye worm)	hypothetical protein	Angiotensin II receptor (AT-1) type-1	359 aa	308 aa	27.6 %
Schistosoma japonicum	Rhodopsin, putative	Angiotensin II type 2 (AT-2) receptor	363 aa	341 aa	22.0 %
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	Angiotensin II receptor (AT-1) type-1	359 aa	346 aa	18.2 %
Onchocerca volvulus	E3 ubiquitin-protein ligase rpm-1 homolog	Angiotensin II receptor (AT-1) type-1	359 aa	354 aa	20.6 %
Onchocerca volvulus		Angiotensin II type 2 (AT-2) receptor	363 aa	305 aa	21.6 %
Onchocerca volvulus		Angiotensin II type 2 (AT-2) receptor	363 aa	306 aa	22.5 %
Brugia malayi	GnHR receptor homolog	Angiotensin II receptor (AT-1) type-1	359 aa	357 aa	20.4 %
Echinococcus multilocularis	G-protein coupled receptor, putative	Angiotensin II receptor (AT-1) type-1	359 aa	307 aa	22.1 %
Echinococcus granulosus	allatostatin A receptor	Angiotensin II type 2 (AT-2) receptor	363 aa	340 aa	24.1 %
Echinococcus granulosus	thyrotropin releasing hormone receptor	Angiotensin II type 2 (AT-2) receptor	363 aa	308 aa	22.1 %
Echinococcus multilocularis	thyrotropin releasing hormone receptor	Angiotensin II type 2 (AT-2) receptor	363 aa	308 aa	21.8 %
Schistosoma mansoni	adenoreceptor	Angiotensin II type 2 (AT-2) receptor	363 aa	328 aa	22.0 %
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	Angiotensin II receptor (AT-1) type-1	359 aa	350 aa	23.1 %
Loa Loa (eye worm)	hypothetical protein	Angiotensin II receptor (AT-1) type-1	359 aa	329 aa	24.0 %
Brugia malayi	ORL1-like opioid receptor	Angiotensin II receptor (AT-1) type-1	359 aa	314 aa	20.4 %
Onchocerca volvulus		Angiotensin II receptor (AT-1) type-1	359 aa	309 aa	18.8 %
Echinococcus multilocularis	neuropeptide receptor	Angiotensin II type 2 (AT-2) receptor	363 aa	308 aa	21.4 %
Schistosoma mansoni	peptide (allatostatin)-like receptor	Angiotensin II type 2 (AT-2) receptor	363 aa	364 aa	20.9 %
Loa Loa (eye worm)	neuropeptide F receptor	Angiotensin II type 2 (AT-2) receptor	363 aa	356 aa	23.3 %
Echinococcus granulosus	growth hormone secretagogue receptor type 1	Angiotensin II receptor (AT-1) type-1	359 aa	343 aa	23.0 %
Echinococcus multilocularis	allatostatin A receptor	Angiotensin II type 2 (AT-2) receptor	363 aa	342 aa	24.6 %
Echinococcus granulosus	neuropeptide receptor	Angiotensin II type 2 (AT-2) receptor	363 aa	306 aa	22.2 %
Echinococcus granulosus	tm gpcr rhodopsin	Angiotensin II receptor (AT-1) type-1	359 aa	300 aa	21.0 %
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	Angiotensin II type 2 (AT-2) receptor	363 aa	398 aa	18.1 %
Onchocerca volvulus		Angiotensin II receptor (AT-1) type-1	359 aa	386 aa	24.4 %
Onchocerca volvulus		Angiotensin II type 2 (AT-2) receptor	363 aa	311 aa	23.8 %
Onchocerca volvulus		Angiotensin II receptor (AT-1) type-1	359 aa	350 aa	24.0 %
Onchocerca volvulus		Angiotensin II receptor (AT-1) type-1	359 aa	314 aa	25.2 %
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	Angiotensin II receptor (AT-1) type-1	359 aa	300 aa	21.0 %
Brugia malayi	putative neuropeptide receptor NPR1	Angiotensin II receptor (AT-1) type-1	359 aa	295 aa	27.1 %
Schistosoma japonicum	ko:K04134 cholinergic receptor, invertebrate, putative	Angiotensin II receptor (AT-1) type-1	359 aa	325 aa	20.9 %
Schistosoma japonicum	ko:K04209 neuropeptide Y receptor, invertebrate, putative	Angiotensin II type 2 (AT-2) receptor	363 aa	310 aa	23.5 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Loa Loa (eye worm)	tubulin alpha chain	0.0225	0.8197	0.8079
Loa Loa (eye worm)	CMGC/CDK/CDK5 protein kinase	0.0047	0.0658	0.005
Echinococcus granulosus	tubulin alpha 1C chain	0.0225	0.8197	0.8079
Loa Loa (eye worm)	CMGC/GSK protein kinase	0.0052	0.088	0.0287
Schistosoma mansoni	tubulin subunit epsilon	0.0154	0.521	0.4898
Leishmania major	alpha tubulin	0.0225	0.8197	0.8079
Echinococcus granulosus	tubulin alpha chain	0.0225	0.8197	0.8079
Plasmodium falciparum	tubulin epsilon chain, putative	0.0154	0.521	0.4873
Loa Loa (eye worm)	tubulin alpha 2	0.0158	0.5361	0.5059
Entamoeba histolytica	tubulin alpha chain, putative	0.0225	0.8197	0.8079
Echinococcus multilocularis	tubulin gamma 1 chain	0.0154	0.521	0.4898
Echinococcus multilocularis	tubulin subunit beta	0.0268	1	1
Echinococcus granulosus	Tubulin alpha 1 chain	0.0225	0.8197	0.8079
Leishmania major	beta tubulin	0.0268	1	1
Echinococcus granulosus	Tubulin beta 2C chain	0.0268	1	1
Trichomonas vaginalis	tubulin beta chain, putative	0.0225	0.8197	0.8197
Trichomonas vaginalis	tubulin, putative	0.0067	0.1515	0.1515
Brugia malayi	Tubulin alpha-2 chain	0.0225	0.8197	0.8079
Echinococcus multilocularis	beta tubulin	0.0268	1	1
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0225	0.8197	0.8079
Trypanosoma brucei	cdc2-related kinase 3	0.0047	0.0658	0.005
Trichomonas vaginalis	conserved hypothetical protein	0.0067	0.1515	0.1515
Echinococcus multilocularis	tubulin alpha	0.0154	0.521	0.4898
Echinococcus multilocularis	cyclin dependent kinase	0.0047	0.0658	0.005
Trypanosoma cruzi	cdc2-related kinase 3	0.0047	0.0658	0.005
Echinococcus granulosus	tubulin alpha chain	0.0225	0.8197	0.8079
Trypanosoma brucei	epsilon tubulin	0.0154	0.521	0.4898
Loa Loa (eye worm)	tubulin alpha-3 chain	0.0138	0.4502	0.4144
Toxoplasma gondii	alpha-tubulin I, putative	0.0225	0.8197	0.807
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0087	0.2374	0.2374
Echinococcus multilocularis	tubulin alpha chain	0.0225	0.8197	0.8079
Echinococcus granulosus	tubulin alpha chain	0.0225	0.8197	0.8079
Toxoplasma gondii	beta tubulin	0.0268	1	1
Leishmania major	alpha tubulin	0.0225	0.8197	0.8079
Brugia malayi	Tubulin alpha chain	0.0225	0.8197	0.8079
Plasmodium falciparum	alpha tubulin 1	0.0225	0.8197	0.807
Trypanosoma brucei	cdc2-related kinase 1	0.0047	0.0658	0.005
Loa Loa (eye worm)	hypothetical protein	0.0225	0.8197	0.8079
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0067	0.1515	0.1515
Loa Loa (eye worm)	hypothetical protein	0.0158	0.5361	0.5059
Plasmodium falciparum	glycogen synthase kinase 3	0.0052	0.088	0.0238
Loa Loa (eye worm)	tubulin beta chain	0.0268	1	1
Trichomonas vaginalis	tubulin alpha chain, putative	0.0087	0.2374	0.2374
Trypanosoma cruzi	zeta tubulin, putative	0.0067	0.1515	0.0963
Giardia lamblia	Beta tubulin	0.0268	1	1
Plasmodium vivax	tubulin gamma chain, putative	0.0154	0.521	0.4873
Brugia malayi	Tubulin gamma chain	0.0154	0.521	0.4898
Leishmania major	beta tubulin	0.0268	1	1
Wolbachia endosymbiont of Brugia malayi	cell division protein FtsZ	0.0067	0.1515	0.5
Trypanosoma brucei	alpha tubulin	0.0225	0.8197	0.8079
Echinococcus granulosus	tubulin alpha	0.0154	0.521	0.4898
Entamoeba histolytica	tubulin alpha-1 chain	0.0225	0.8197	0.8079
Trypanosoma brucei	epsilon tubulin	0.0154	0.521	0.4898
Echinococcus multilocularis	Tubulin beta 2C chain	0.0268	1	1
Echinococcus multilocularis	peroxisome assembly protein 26	0.0225	0.8197	0.8079
Loa Loa (eye worm)	tubulin alpha 2	0.0071	0.1666	0.1124
Trypanosoma cruzi	epsilon tubulin, putative	0.0154	0.521	0.4898
Trichomonas vaginalis	cyclin B, putative	0.0046	0.0611	0.0611
Plasmodium vivax	tubulin alpha chain, putative	0.0225	0.8197	0.807
Leishmania major	alpha tubulin	0.0225	0.8197	0.8079
Leishmania major	beta tubulin	0.0268	1	1
Echinococcus multilocularis	tubulin beta 1 chain	0.0268	1	1
Echinococcus granulosus	cyclin dependent kinase 5	0.0047	0.0658	0.005
Echinococcus multilocularis	protein kinase shaggy	0.0052	0.088	0.0287
Loa Loa (eye worm)	tubulin alpha 2	0.0158	0.5361	0.5059
Echinococcus granulosus	Tubulin beta 2C chain	0.0268	1	1
Leishmania major	beta tubulin	0.0268	1	1
Brugia malayi	Tubulin beta chain	0.0087	0.2374	0.1878
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0225	0.8197	0.8197
Giardia lamblia	Kinase, CMGC CDK	0.0047	0.0658	0.005
Onchocerca volvulus		0.0087	0.2374	1
Trypanosoma brucei	beta tubulin	0.0268	1	1
Plasmodium falciparum	alpha tubulin 2	0.0225	0.8197	0.807
Echinococcus granulosus	tubulin beta 1 chain	0.0268	1	1
Trypanosoma brucei	beta tubulin	0.0154	0.521	0.4898
Loa Loa (eye worm)	alpha-tubulin	0.0225	0.8197	0.8079
Echinococcus granulosus	beta tubulin	0.0268	1	1
Trypanosoma brucei	tubulin delta chain	0.0067	0.1515	0.0963
Plasmodium vivax	tubulin alpha chain, putative	0.0225	0.8197	0.807
Echinococcus granulosus	tubulin epsilon chain	0.0154	0.521	0.4898
Schistosoma mansoni	tubulin subunit alpha	0.0225	0.8197	0.8079
Schistosoma mansoni	tubulin subunit beta	0.0268	1	1
Toxoplasma gondii	beta-tubulin, putative	0.0268	1	1
Trichomonas vaginalis	tubulin alpha chain, putative	0.0154	0.521	0.521
Giardia lamblia	Alpha-tubulin	0.0225	0.8197	0.8079
Leishmania major	beta tubulin	0.0268	1	1
Trypanosoma brucei	beta tubulin	0.0268	1	1
Trypanosoma cruzi	tubulin gamma chain	0.0154	0.521	0.4898
Entamoeba histolytica	protein kinase, putative	0.0052	0.088	0.0287
Trichomonas vaginalis	tubulin beta chain, putative	0.0225	0.8197	0.8197
Trichomonas vaginalis	cyclin A, putative	0.0046	0.0611	0.0611
Schistosoma mansoni	tubulin subunit beta	0.0268	1	1
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0268	1	1
Echinococcus granulosus	tubulin beta 4A class IVa	0.0268	1	1
Leishmania major	gamma-tubulin	0.0154	0.521	0.4898
Trichomonas vaginalis	tubulin, putative	0.0268	1	1
Trypanosoma cruzi	cdc2-related kinase 1	0.0047	0.0658	0.005
Echinococcus multilocularis	Tubulin beta 2C chain	0.0268	1	1
Echinococcus granulosus	tubulin delta chain	0.0067	0.1515	0.0963
Leishmania major	beta tubulin	0.0268	1	1
Toxoplasma gondii	cell-cycle-associated protein kinase GSK, putative	0.0052	0.088	0.0238
Toxoplasma gondii	tubulin/FtsZ family, GTPase domain-containing protein	0.0067	0.1515	0.0918
Echinococcus granulosus	peroxisome assembly protein 26	0.0225	0.8197	0.8079
Echinococcus granulosus	beta tubulin	0.0268	1	1
Echinococcus multilocularis	hypothetical protein	0.0225	0.8197	0.8079
Schistosoma mansoni	tubulin subunit beta	0.0268	1	1
Brugia malayi	beta-tubulin, identical	0.0268	1	1
Brugia malayi	cell division control protein 2 homolog	0.0047	0.0658	0.005
Echinococcus multilocularis	tubulin alpha chain	0.0225	0.8197	0.8079
Schistosoma mansoni	tubulin subunit alpha	0.0225	0.8197	0.8079
Plasmodium vivax	delta tubulin, putative	0.0067	0.1515	0.0918
Echinococcus multilocularis	tubulin alpha 1C chain	0.0225	0.8197	0.8079
Giardia lamblia	Kinase, CMGC GSK	0.0052	0.088	0.0287
Leishmania major	beta tubulin	0.0268	1	1
Echinococcus multilocularis	tubulin epsilon chain	0.0154	0.521	0.4898
Echinococcus granulosus	protein kinase shaggy	0.0052	0.088	0.0287
Echinococcus granulosus	cyclin dependent kinase 1	0.0047	0.0658	0.005
Loa Loa (eye worm)	CMGC/CDK/CDC2 protein kinase	0.0047	0.0658	0.005
Echinococcus multilocularis	tubulin alpha 1C chain	0.0225	0.8197	0.8079
Schistosoma mansoni	tubulin subunit beta	0.0268	1	1
Giardia lamblia	Gamma tubulin	0.0154	0.521	0.4898
Loa Loa (eye worm)	tubulin gamma chain	0.0154	0.521	0.4898
Leishmania major	cell division related protein kinase 2,cdc2-related kinase	0.0047	0.0658	0.005
Entamoeba histolytica	tubulin gamma chain	0.0154	0.521	0.4898
Trypanosoma brucei	beta tubulin	0.0268	1	1
Trypanosoma cruzi	zeta tubulin, putative	0.0067	0.1515	0.0963
Giardia lamblia	Epsilon tubulin	0.0067	0.1515	0.0963
Trichomonas vaginalis	cyclin B, putative	0.0046	0.0611	0.0611
Echinococcus granulosus	Tubulin alpha 1 chain	0.0225	0.8197	0.8079
Echinococcus granulosus	tubulin alpha chain	0.0225	0.8197	0.8079
Brugia malayi	Protein kinase domain containing protein	0.0047	0.0658	0.005
Echinococcus granulosus	tubulin alpha 1C chain	0.0225	0.8197	0.8079
Brugia malayi	tubulin alpha chain - mouse	0.0225	0.8197	0.8079
Giardia lamblia	Beta tubulin	0.0268	1	1
Trypanosoma cruzi	cdc2-related kinase 3	0.0047	0.0658	0.005
Trypanosoma brucei	alpha tubulin	0.0225	0.8197	0.8079
Echinococcus granulosus	Tubulin beta 2C chain	0.0268	1	1
Plasmodium falciparum	tubulin gamma chain	0.0154	0.521	0.4873
Mycobacterium tuberculosis	Cell division protein FtsZ	0.0067	0.1515	0.5
Echinococcus granulosus	Tubulin alpha 1 chain	0.0225	0.8197	0.8079
Loa Loa (eye worm)	tubulin beta chain	0.0067	0.1515	0.0963
Brugia malayi	intracellular kinase	0.0052	0.088	0.0287
Trichomonas vaginalis	tubulin gamma chain, putative	0.0154	0.521	0.521
Trichomonas vaginalis	cyclin B, putative	0.0046	0.0611	0.0611
Trichomonas vaginalis	cyclins, putative	0.0046	0.0611	0.0611
Trypanosoma brucei	beta tubulin	0.0268	1	1
Schistosoma mansoni	tubulin subunit alpha	0.0067	0.1515	0.0963
Trichomonas vaginalis	CMGC family protein kinase	0.0047	0.0658	0.0658
Leishmania major	beta tubulin	0.0268	1	1
Echinococcus granulosus	tubulin subunit TubB	0.0225	0.8197	0.8079
Loa Loa (eye worm)	alpha-tubulin isotype 2	0.0158	0.5361	0.5059
Onchocerca volvulus		0.0052	0.088	0.1527
Echinococcus granulosus	Tubulin beta 2C chain	0.0268	1	1
Echinococcus granulosus	tubulin alpha chain	0.0225	0.8197	0.8079
Trichomonas vaginalis	cyclins, putative	0.0046	0.0611	0.0611
Leishmania major	cell division protein kinase 2,cdc2-related kinase	0.0047	0.0658	0.005
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0158	0.5361	0.5361
Entamoeba histolytica	protein kinase domain containing protein	0.0052	0.088	0.0287
Plasmodium vivax	glycogen synthase kinase 3, putative	0.0052	0.088	0.0238
Schistosoma mansoni	serine/threonine protein kinase	0.0047	0.0658	0.005
Echinococcus granulosus	glycogen synthase kinase 3 beta	0.0052	0.088	0.0287
Loa Loa (eye worm)	tubulin beta-4 chain	0.0268	1	1
Loa Loa (eye worm)	CMGC/GSK protein kinase	0.0052	0.088	0.0287
Trichomonas vaginalis	CMGC family protein kinase	0.0052	0.088	0.088
Trypanosoma brucei	alpha tubulin, putative	0.0087	0.2374	0.1878
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0616	0.0005
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0138	0.4502	0.4502
Leishmania major	alpha tubulin	0.0225	0.8197	0.8079
Echinococcus multilocularis	cyclin dependent kinase 5	0.0047	0.0658	0.005
Brugia malayi	Tubulin alpha-2 chain	0.0225	0.8197	0.8079
Brugia malayi	Tubulin beta chain	0.0067	0.1515	0.0963
Brugia malayi	Cell division protein ftsZ	0.0067	0.1515	0.0963
Leishmania major	alpha tubulin	0.0225	0.8197	0.8079
Entamoeba histolytica	cell division protein kinase 2, putative	0.0047	0.0658	0.005
Leishmania major	epsilon tubulin, putative	0.0154	0.521	0.4898
Plasmodium vivax	tubulin epsilon chain, putative	0.0154	0.521	0.4873
Trypanosoma brucei	protein kinase, putative	0.0052	0.088	0.0287
Loa Loa (eye worm)	beta-tubulin	0.0268	1	1
Giardia lamblia	Kinase, CMGC GSK	0.0052	0.088	0.0287
Trichomonas vaginalis	CMGC family protein kinase	0.0047	0.0658	0.0658
Echinococcus multilocularis	tubulin alpha chain	0.0225	0.8197	0.8079
Trichomonas vaginalis	tubulin beta chain, putative	0.0225	0.8197	0.8197
Toxoplasma gondii	tubulin/FtsZ family, GTPase domain-containing protein	0.0067	0.1515	0.0918
Schistosoma mansoni	alpha tubulin	0.0225	0.8197	0.8079
Loa Loa (eye worm)	BEN-1 protein	0.0268	1	1
Loa Loa (eye worm)	tubulin beta-2A chain	0.0268	1	1
Trypanosoma brucei	epsilon tubulin	0.0154	0.521	0.4898
Trichomonas vaginalis	tubulin gamma chain, putative	0.0154	0.521	0.521
Trichomonas vaginalis	conserved hypothetical protein	0.0067	0.1515	0.1515
Trichomonas vaginalis	tubulin beta chain, putative	0.0087	0.2374	0.2374
Leishmania major	beta tubulin	0.0268	1	1
Leishmania major	zeta tubulin, putative	0.0067	0.1515	0.0963
Trypanosoma brucei	zeta tubulin, putative	0.0067	0.1515	0.0963
Trichomonas vaginalis	tubulin alpha chain, putative	0.0268	1	1
Trichomonas vaginalis	tubulin gamma chain, putative	0.0268	1	1
Loa Loa (eye worm)	tubulin alpha chain	0.0225	0.8197	0.8079
Schistosoma mansoni	serine/threonine protein kinase	0.0047	0.0658	0.005
Toxoplasma gondii	tubulin/FtsZ family, GTPase domain-containing protein	0.0154	0.521	0.4873
Entamoeba histolytica	cell division protein kinase 2, putative	0.0047	0.0658	0.005
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0225	0.8197	0.8197
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0225	0.8197	0.8079
Trichomonas vaginalis	tubulin alpha chain, putative	0.0087	0.2374	0.2374
Trichomonas vaginalis	tubulin, putative	0.0087	0.2374	0.2374
Echinococcus multilocularis	cyclin dependent kinase 1	0.0047	0.0658	0.005
Echinococcus granulosus	5'partial\|cyclin dependent kinase 1	0.0047	0.0658	0.005
Leishmania major	alpha tubulin	0.0225	0.8197	0.8079
Schistosoma mansoni	tubulin subunit alpha	0.0225	0.8197	0.8079
Leishmania major	alpha tubulin	0.0225	0.8197	0.8079
Schistosoma mansoni	alpha tubulin	0.0225	0.8197	0.8079
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0225	0.8197	0.8079
Leishmania major	beta tubulin	0.0268	1	1
Trichomonas vaginalis	tubulin, putative	0.0087	0.2374	0.2374
Loa Loa (eye worm)	tubulin beta-1 chain	0.0268	1	1
Treponema pallidum	cell division protein FtsZ	0.0067	0.1515	0.5
Echinococcus granulosus	tubulin alpha 3 chain	0.0225	0.8197	0.8079
Echinococcus multilocularis	glycogen synthase kinase 3 beta	0.0052	0.088	0.0287
Leishmania major	glycogen synthase kinase, putative;with=GeneDB:LinJ18_V3.0270	0.0052	0.088	0.0287
Schistosoma mansoni	alpha tubulin	0.0225	0.8197	0.8079
Echinococcus multilocularis	tubulin alpha 3 chain	0.0225	0.8197	0.8079
Echinococcus granulosus	tubulin subunit beta	0.0268	1	1
Trichomonas vaginalis	tubulin beta chain, putative	0.0268	1	1
Leishmania major	beta tubulin	0.0268	1	1
Toxoplasma gondii	alpha tubulin TUBA1	0.0225	0.8197	0.807
Plasmodium falciparum	tubulin delta chain, putative	0.0067	0.1515	0.0918
Trichomonas vaginalis	cyclins, putative	0.0046	0.0611	0.0611
Echinococcus multilocularis	Tubulin beta 2C chain	0.0268	1	1
Schistosoma mansoni	tubulin subunit gamma	0.0154	0.521	0.4898
Loa Loa (eye worm)	tubulin alpha-2 chain	0.0225	0.8197	0.8079
Trypanosoma cruzi	tubulin delta chain	0.0067	0.1515	0.0963
Echinococcus granulosus	tubulin gamma 1 chain	0.0154	0.521	0.4898
Echinococcus multilocularis	beta tubulin	0.0268	1	1
Trypanosoma cruzi	alpha tubulin, putative	0.0225	0.8197	0.8079
Leishmania major	alpha tubulin	0.0225	0.8197	0.8079
Toxoplasma gondii	beta-1 tubulin, putative	0.0268	1	1
Trichomonas vaginalis	cyclin B, putative	0.0046	0.0611	0.0611
Brugia malayi	alpha-tubulin	0.0225	0.8197	0.8079
Brugia malayi	tubulin alpha-2 chain	0.0225	0.8197	0.8079
Trypanosoma cruzi	tubulin delta chain	0.0067	0.1515	0.0963
Trichomonas vaginalis	CMGC family protein kinase	0.0052	0.088	0.088
Trypanosoma cruzi	epsilon tubulin, putative	0.0154	0.521	0.4898
Echinococcus multilocularis	tubulin delta chain	0.0067	0.1515	0.0963
Entamoeba histolytica	tubulin family protein	0.0268	1	1
Echinococcus multilocularis	tubulin, beta 4A class IVa	0.0268	1	1
Entamoeba histolytica	tubulin family protein	0.0268	1	1
Trichomonas vaginalis	tubulin beta chain, putative	0.0225	0.8197	0.8197
Schistosoma mansoni	glycogen synthase kinase 3-related (gsk3) (cmgc group III)	0.0052	0.088	0.0287
Plasmodium falciparum	tubulin beta chain	0.0268	1	1
Echinococcus multilocularis	Tubulin beta 2C chain	0.0268	1	1
Loa Loa (eye worm)	alpha-tubulin	0.0225	0.8197	0.8079
Echinococcus granulosus	alpha tubulin	0.0225	0.8197	0.8079
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0268	1	1
Entamoeba histolytica	protein kinase domain containing protein	0.0052	0.088	0.0287
Loa Loa (eye worm)	hypothetical protein	0.0138	0.4502	0.4144
Trypanosoma brucei	zeta tubulin	0.0067	0.1515	0.0963
Mycobacterium ulcerans	cell division protein FtsZ	0.0067	0.1515	0.5
Leishmania major	beta tubulin	0.0268	1	1
Leishmania major	alpha tubulin	0.0225	0.8197	0.8079
Schistosoma mansoni	tubulin subunit beta	0.0268	1	1
Schistosoma mansoni	tubulin subunit delta	0.0067	0.1515	0.0963
Leishmania major	beta tubulin	0.0268	1	1
Leishmania major	beta tubulin	0.0268	1	1
Giardia lamblia	Beta tubulin	0.0268	1	1
Plasmodium vivax	tubulin beta chain, putative	0.0268	1	1
Echinococcus multilocularis	tubulin alpha 3 chain	0.0225	0.8197	0.8079
Trypanosoma cruzi	beta tubulin, putative	0.0268	1	1
Schistosoma mansoni	tubulin subunit beta	0.0067	0.1515	0.0963
Leishmania major	beta tubulin	0.0268	1	1
Leishmania major	alpha tubulin	0.0225	0.8197	0.8079
Trypanosoma brucei	alpha tubulin	0.0225	0.8197	0.8079
Leishmania major	alpha tubulin	0.0225	0.8197	0.8079
Trichomonas vaginalis	tubulin beta-1 chain, putative	0.0067	0.1515	0.1515
Trypanosoma cruzi	glycogen synthase kinase 3, putative	0.0052	0.088	0.0287
Schistosoma mansoni	tubulin subunit beta	0.0268	1	1
Echinococcus multilocularis	Tubulin beta 2C chain	0.0268	1	1
Leishmania major	alpha tubulin	0.0225	0.8197	0.8079
Trichomonas vaginalis	tubulin beta chain, putative	0.0225	0.8197	0.8197
Leishmania major	beta tubulin	0.0268	1	1
Echinococcus multilocularis	tubulin subunit TubB	0.0225	0.8197	0.8079
Trichomonas vaginalis	cyclins, putative	0.0046	0.0611	0.0611
Loa Loa (eye worm)	BEN-1 protein	0.0268	1	1
Giardia lamblia	Alpha-tubulin	0.0225	0.8197	0.8079
Echinococcus multilocularis	tubulin alpha chain	0.0225	0.8197	0.8079
Loa Loa (eye worm)	CMGC/CDK/CDC2 protein kinase	0.0047	0.0658	0.005
Giardia lamblia	Delta tubulin	0.0067	0.1515	0.0963
Trypanosoma brucei	alpha tubulin	0.0225	0.8197	0.8079
Echinococcus multilocularis	cyclin dependent kinase 1	0.0047	0.0658	0.005
Echinococcus granulosus	tubulin alpha 3 chain	0.0225	0.8197	0.8079
Mycobacterium leprae	cell division protein FtsZ	0.0067	0.1515	0.5
Trichomonas vaginalis	CMGC family protein kinase	0.0047	0.0658	0.0658
Echinococcus granulosus	cyclin dependent kinase	0.0047	0.0658	0.005
Leishmania major	beta tubulin	0.0268	1	1
Brugia malayi	Tubulin alpha chain	0.0067	0.1515	0.0963
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0225	0.8197	0.8197
Trichomonas vaginalis	tubulin gamma chain, putative	0.0067	0.1515	0.1515
Trypanosoma cruzi	cdc2-related kinase 1	0.0047	0.0658	0.005
Giardia lamblia	Kinase, CMGC CDK	0.0047	0.0658	0.005
Trypanosoma brucei	tubulin gamma chain	0.0154	0.521	0.4898
Trichomonas vaginalis	tubulin alpha chain, putative	0.0087	0.2374	0.2374
Trichomonas vaginalis	tubulin beta chain, putative	0.0225	0.8197	0.8197
Leishmania major	beta tubulin	0.0268	1	1
Echinococcus granulosus	Tubulin beta 2C chain	0.0268	1	1
Leishmania major	delta tubulin, putative	0.0067	0.1515	0.0963
Echinococcus multilocularis	tubulin alpha chain	0.0225	0.8197	0.8079

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	> 10 uM	Binding affinity towards Angiotensin II receptor, type 1 in rat isolated adrenal cortical microsomes	ChEMBL.	8258820
IC50 (binding)	> 10 uM	Binding affinity towards Angiotensin II receptor, type 2 in rat isolated adrenal medullary microsomes	ChEMBL.	8258820
IC50 (binding)	> 10 uM	Binding affinity towards Angiotensin II receptor, type 1 in rat isolated adrenal cortical microsomes	ChEMBL.	8258820
IC50 (binding)	> 10 uM	Binding affinity towards Angiotensin II receptor, type 2 in rat isolated adrenal medullary microsomes	ChEMBL.	8258820

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: CHEMBL128233
PubChem: 10413836

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 224781