TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 376.495 | Formula: C23H28N4O
H donors: 0 H acceptors: 1 LogP: 4.09 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: COc1ccccc1N1CCN(CC1)Cc1c(C)nn(c1C)c1ccccc1
InChi: 1S/C23H28N4O/c1-18-21(19(2)27(24-18)20-9-5-4-6-10-20)17-25-13-15-26(16-14-25)22-11-7-8-12-23(22)28-3/h4-12H,13-17H2,1-3H3
InChiKey: KYLJPWUYWQONIV-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	smoothened, frizzled class receptor	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_134998	All targets in OG5_134998
Echinococcus granulosus	smoothened	Get druggable targets OG5_134998	All targets in OG5_134998
Echinococcus multilocularis	smoothened	Get druggable targets OG5_134998	All targets in OG5_134998

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 brucei	DNA polymerase kappa, putative	0.0041	0.0436	0.8418
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0016	0.0106	0.0549
Schistosoma mansoni	terminal deoxycytidyl transferase	0.0015	0.0082	0.0155
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0029	0.0272	0.027
Echinococcus multilocularis	secreted frizzled protein 5	0.0008	0.0002	0.0004
Wolbachia endosymbiont of Brugia malayi	dihydrolipoamide dehydrogenase E3 component	0.0016	0.0106	1
Schistosoma mansoni	frizzled-like receptor	0.0018	0.0135	0.0253
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0046	0.0493	0.0491
Mycobacterium tuberculosis	Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB	0.0107	0.1313	0.3654
Mycobacterium ulcerans	dihydrolipoamide dehydrogenase, LpdB	0.0016	0.0106	0.0295
Schistosoma mansoni	dihydrolipoamide dehydrogenase	0.0016	0.0106	0.0199
Trichomonas vaginalis	DNA polymerase eta, putative	0.0041	0.0436	0.0436
Echinococcus granulosus	dihydrolipoamide dehydrogenase	0.0016	0.0106	0.0199
Treponema pallidum	hypothetical protein	0.0279	0.3592	1
Schistosoma mansoni	hypothetical protein	0.001	0.0023	0.0042
Brugia malayi	ImpB/MucB/SamB family protein	0.0015	0.0082	0.008
Brugia malayi	CXXC zinc finger family protein	0.0029	0.0272	0.027
Mycobacterium tuberculosis	Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed))	0.0021	0.017	0.0474
Plasmodium vivax	glutathione reductase, putative	0.0047	0.0514	0.1169
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0016	0.0106	0.0549
Onchocerca volvulus	Glucosylceramidase homolog	0.05	0.6523	1
Trichomonas vaginalis	DNA polymerase IV / kappa, putative	0.0041	0.0436	0.0436
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0016	0.01	0.0187
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0047	0.0514	0.0964
Trypanosoma brucei	dihydrolipoamide dehydrogenase	0.0016	0.0106	0.1699
Loa Loa (eye worm)	hypothetical protein	0.001	0.0023	0.002
Loa Loa (eye worm)	glutathione reductase	0.0047	0.0514	0.0511
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0041	0.0436	0.8199
Brugia malayi	Frizzled/Smoothened family membrane region containing protein	0.001	0.0023	0.002
Toxoplasma gondii	thioredoxin reductase	0.0047	0.0514	0.8268
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0016	0.0106	0.0549
Schistosoma mansoni	cpg binding protein	0.0029	0.0272	0.051
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.0119	0.1471	0.4096
Leishmania major	acetoin dehydrogenase e3 component-like protein	0.0016	0.0106	0.0549
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0041	0.0436	0.8199
Echinococcus multilocularis	secreted frizzled protein	0.0008	0.0002	0.0004
Brugia malayi	dihydrolipoyl dehydrogenase, mitochondrial precursor, putative	0.0016	0.0106	0.0104
Echinococcus granulosus	thioredoxin glutathione reductase	0.0047	0.0514	0.0964
Trypanosoma brucei	dihydrolipoyl dehydrogenase	0.0016	0.0106	0.1699
Loa Loa (eye worm)	histone methyltransferase	0.0009	0.0008	0.0006
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0303	0.0301
Trichomonas vaginalis	glucosylceramidase, putative	0.0763	1	1
Trichomonas vaginalis	glucosylceramidase, putative	0.05	0.6523	0.6523
Brugia malayi	polk-prov protein	0.0031	0.0303	0.0301
Loa Loa (eye worm)	hypothetical protein	0.001	0.0023	0.002
Schistosoma mansoni	hypothetical protein	0.0016	0.01	0.0187
Trypanosoma brucei	unspecified product	0.0035	0.0348	0.6631
Leishmania major	2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein	0.0016	0.0106	0.0549
Schistosoma mansoni	cpg binding protein	0.003	0.0294	0.0551
Echinococcus granulosus	dna polymerase kappa	0.0041	0.0436	0.0818
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0016	0.0106	0.0549
Mycobacterium tuberculosis	Putative ferredoxin reductase	0.0107	0.1313	0.3654
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0436	0.8418
Echinococcus granulosus	terminal deoxycytidyl transferase rev1	0.0015	0.0082	0.0155
Toxoplasma gondii	pyruvate dehydrogenase complex subunit PDH-E3II	0.0016	0.0106	0.1192
Mycobacterium ulcerans	bifunctional nicotinate-nucleotide adenylyltransferase NadD/hypothetical protein	0.0279	0.3592	1
Trypanosoma brucei	dihydrolipoamide dehydrogenase	0.0016	0.0106	0.1699
Trypanosoma brucei	DNA polymerase IV, putative	0.0041	0.0436	0.8418
Echinococcus granulosus	secreted frizzled protein	0.0008	0.0002	0.0004
Mycobacterium ulcerans	DNA polymerase IV	0.0041	0.0436	0.1214
Brugia malayi	glutathione reductase	0.0047	0.0514	0.0511
Loa Loa (eye worm)	frizzled/Smoothened family membrane region containing protein	0.0018	0.0135	0.0133
Trypanosoma cruzi	dihydrolipoyl dehydrogenase, putative	0.0016	0.0106	0.0549
Mycobacterium tuberculosis	Probable membrane NADH dehydrogenase NdhA	0.0107	0.1313	0.3654
Leishmania major	DNA polymerase kappa, putative,DNA polymerase IV, putative	0.0021	0.017	0.2034
Leishmania major	dihydrolipoamide dehydrogenase, putative	0.0016	0.0106	0.0549
Loa Loa (eye worm)	frizzled/Smoothened family membrane region containing protein	0.0018	0.0135	0.0133
Trypanosoma brucei	dihydrolipoamide dehydrogenase, point mutation	0.0016	0.0106	0.1699
Trichomonas vaginalis	glucosylceramidase, putative	0.05	0.6523	0.6523
Trypanosoma brucei	DNA polymerase kappa, putative	0.0017	0.011	0.1787
Onchocerca volvulus		0.0029	0.0272	0.0413
Echinococcus multilocularis	dna polymerase eta	0.0015	0.0082	0.0155
Brugia malayi	Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein	0.0012	0.0049	0.0046
Echinococcus granulosus	frizzled 4	0.0018	0.0135	0.0253
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0061	0.07	0.1314
Brugia malayi	latrophilin 2 splice variant baaae	0.0034	0.0343	0.0341
Schistosoma mansoni	hypothetical protein	0.0016	0.01	0.0187
Trichomonas vaginalis	glucosylceramidase, putative	0.05	0.6523	0.6523
Echinococcus multilocularis	frizzled 10	0.0018	0.0135	0.0253
Brugia malayi	Latrophilin receptor protein 2	0.0016	0.01	0.0097
Schistosoma mansoni	DNA polymerase eta	0.0015	0.0082	0.0155
Mycobacterium ulcerans	DNA polymerase IV	0.0041	0.0436	0.1214
Trypanosoma brucei	DNA polymerase kappa, putative	0.0021	0.017	0.3003
Plasmodium falciparum	glutathione reductase	0.0047	0.0514	0.1169
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0436	0.8418
Trichomonas vaginalis	glucosylceramidase, putative	0.05	0.6523	0.6523
Trypanosoma brucei	DNA polymerase IV, putative	0.0035	0.0348	0.6631
Trypanosoma cruzi	trypanothione reductase, putative	0.0016	0.0106	0.0549
Brugia malayi	alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase	0.0012	0.0049	0.0046
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0436	0.8418
Schistosoma mansoni	frizzled-like receptor	0.0018	0.0135	0.0253
Trypanosoma brucei	DNA polymerase kappa, putative	0.0031	0.0303	0.5715
Trichomonas vaginalis	glucosylceramidase, putative	0.05	0.6523	0.6523
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0343	0.0341
Mycobacterium leprae	PROBABLE NICOTINATE-NUCLEOTIDE ADENYLYLTRANSFERASE NADD (DEAMIDO-NAD(+) PYROPHOSPHORYLASE) (DEAMIDO-NAD(+) DIPHOSPHORYLASE) (NIC	0.0279	0.3592	1
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0009	0.0008	0.0015
Mycobacterium tuberculosis	Probable oxidoreductase	0.0119	0.1471	0.4096
Leishmania major	DNA polymerase kappa, putative	0.0021	0.017	0.2034
Leishmania major	trypanothione reductase	0.0047	0.0514	1
Loa Loa (eye worm)	frizzled/Smoothened family membrane region containing protein	0.001	0.0023	0.002
Loa Loa (eye worm)	ImpB/MucB/SamB family protein	0.0015	0.0082	0.008
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0016	0.01	0.0187
Echinococcus multilocularis	GPCR, family 2	0.0016	0.01	0.0187
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0436	0.8418
Echinococcus multilocularis	terminal deoxycytidyl transferase rev1	0.0015	0.0082	0.0155
Brugia malayi	ImpB/MucB/SamB family protein	0.0015	0.0082	0.008
Loa Loa (eye worm)	hypothetical protein	0.001	0.0023	0.002
Giardia lamblia	DINP protein human, muc B family	0.0021	0.017	1
Mycobacterium ulcerans	dihydrolipoamide dehydrogenase	0.0016	0.0106	0.0295
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.005	0.0553	0.0551
Trichomonas vaginalis	glucosylceramidase, putative	0.0763	1	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0436	0.8418
Plasmodium vivax	nicotinate-nucleotide adenylyltransferase, putative	0.0279	0.3592	1
Mycobacterium tuberculosis	Probable NADH dehydrogenase Ndh	0.0107	0.1313	0.3654
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0119	0.1471	0.4096
Treponema pallidum	NADH oxidase	0.0016	0.0106	0.0295
Echinococcus multilocularis	dna polymerase kappa	0.0041	0.0436	0.0818
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0016	0.0106	0.0549
Mycobacterium tuberculosis	NADPH-dependent mycothiol reductase Mtr	0.0047	0.0514	0.143
Echinococcus multilocularis	cpg binding protein	0.003	0.0294	0.0551
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0046	0.0493	0.0926
Entamoeba histolytica	deoxycytidyl transferase, putative	0.0015	0.0082	0.5
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0041	0.0436	0.8199
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.005	0.0553	0.0551
Mycobacterium tuberculosis	Probable dehydrogenase	0.0107	0.1313	0.3654
Loa Loa (eye worm)	O-glycosyl hydrolase family 30 protein	0.0763	1	1
Toxoplasma gondii	NADPH-glutathione reductase	0.0016	0.0106	0.1192
Trichomonas vaginalis	glucosylceramidase, putative	0.05	0.6523	0.6523
Schistosoma mansoni	cpg binding protein	0.003	0.0294	0.0551
Trichomonas vaginalis	glucosylceramidase, putative	0.0527	0.6881	0.6881
Brugia malayi	Frizzled/Smoothened family membrane region containing protein	0.0018	0.0135	0.0133
Trypanosoma brucei	DNA polymerase kappa, putative	0.0017	0.011	0.1787
Echinococcus multilocularis	frizzled	0.0018	0.0135	0.0253
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0016	0.01	0.0187
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0009	0.0008	0.0015
Brugia malayi	F/Y-rich N-terminus family protein	0.0009	0.0007	0.0004
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0046	0.0493	0.0926
Trichomonas vaginalis	mercuric reductase, putative	0.0016	0.0106	0.0106
Trichomonas vaginalis	glucosylceramidase, putative	0.0763	1	1
Trichomonas vaginalis	glucosylceramidase, putative	0.0527	0.6881	0.6881
Trichomonas vaginalis	glucosylceramidase, putative	0.0763	1	1
Echinococcus granulosus	dna polymerase eta	0.0015	0.0082	0.0155
Brugia malayi	Frizzled/Smoothened family membrane region containing protein	0.0018	0.0135	0.0133
Echinococcus granulosus	GPCR family 2	0.0016	0.01	0.0187
Echinococcus multilocularis	frizzled 5	0.0018	0.0135	0.0253
Schistosoma mansoni	frizzled-like receptor	0.001	0.0023	0.0042
Schistosoma mansoni	secreted frizzled-related protein	0.0008	0.0002	0.0004
Schistosoma mansoni	frizzled-like receptor	0.001	0.0023	0.0042
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0015	0.0082	0.0229
Schistosoma mansoni	hypothetical protein	0.0034	0.0343	0.0644
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0082	0.008
Mycobacterium tuberculosis	Probable nicotinate-nucleotide adenylyltransferase NadD (deamido-NAD(+) pyrophosphorylase) (deamido-NAD(+) diphosphorylase) (nic	0.0279	0.3592	1
Trypanosoma cruzi	trypanothione reductase, putative	0.0047	0.0514	1
Echinococcus multilocularis	secreted frizzled protein	0.0008	0.0002	0.0004
Wolbachia endosymbiont of Brugia malayi	dihydrolipoamide dehydrogenase E3 component	0.0016	0.0106	1
Mycobacterium tuberculosis	Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot	0.0016	0.0106	0.0295
Schistosoma mansoni	hypothetical protein	0.0016	0.01	0.0187
Echinococcus multilocularis	dnaJ subfamily B	0.041	0.5328	1
Plasmodium falciparum	nicotinamide/nicotinic acid mononucleotide adenylyltransferase	0.0279	0.3592	1
Trichomonas vaginalis	glucosylceramidase, putative	0.05	0.6523	0.6523
Trypanosoma cruzi	dihydrolipoyl dehydrogenase, putative	0.0016	0.0106	0.0549
Schistosoma mansoni	hypothetical protein	0.001	0.0023	0.0042
Brugia malayi	Thioredoxin reductase	0.0047	0.0514	0.0511
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0436	0.8418
Trypanosoma brucei	DNA polymerase kappa, putative	0.0017	0.011	0.1787
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0436	0.8418
Mycobacterium ulcerans	flavoprotein disulfide reductase	0.0016	0.0106	0.0295
Echinococcus granulosus	smoothened	0.041	0.5325	0.9995
Schistosoma mansoni	wnt inhibitor frzb2	0.0008	0.0002	0.0004
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0016	0.01	0.0097
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0055	0.0613	1
Echinococcus multilocularis	smoothened	0.041	0.5325	0.9995
Echinococcus granulosus	dnaJ subfamily B	0.041	0.5328	1
Mycobacterium leprae	PROBABLE NADH DEHYDROGENASE NDH	0.0107	0.1313	0.3654
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0046	0.0493	0.0926
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0016	0.01	0.0187
Trichomonas vaginalis	glucosylceramidase, putative	0.0763	1	1
Trypanosoma brucei	trypanothione reductase	0.0047	0.0514	1
Schistosoma mansoni	hypothetical protein	0.0016	0.01	0.0187
Brugia malayi	Calcitonin receptor-like protein seb-1	0.005	0.0553	0.0551
Echinococcus multilocularis	dihydrolipoamide dehydrogenase	0.0016	0.0106	0.0199
Schistosoma mansoni	hypothetical protein	0.041	0.5328	1
Loa Loa (eye worm)	hypothetical protein	0.0402	0.5213	0.5212
Plasmodium vivax	thioredoxin reductase, putative	0.0047	0.0514	0.1169
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0046	0.0493	0.0926
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0046	0.0493	0.0926
Loa Loa (eye worm)	thioredoxin reductase	0.0047	0.0514	0.0511
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0046	0.0493	0.0926
Plasmodium falciparum	thioredoxin reductase	0.0047	0.0514	0.1169
Echinococcus granulosus	secreted frizzled protein 5	0.0008	0.0002	0.0004
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0046	0.0493	0.0926
Echinococcus granulosus	frizzled	0.0018	0.0135	0.0253
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0016	0.0106	0.0549
Chlamydia trachomatis	dihydrolipoyl dehydrogenase	0.0016	0.0106	0.5
Trichomonas vaginalis	glutathione reductase, putative	0.0016	0.0106	0.0106
Trichomonas vaginalis	glucosylceramidase, putative	0.0763	1	1
Loa Loa (eye worm)	hypothetical protein	0.0016	0.01	0.0097
Echinococcus granulosus	frizzled 5	0.0018	0.0135	0.0253
Mycobacterium tuberculosis	Probable reductase	0.0107	0.1313	0.3654
Schistosoma mansoni	frizzled	0.0018	0.0135	0.0253
Echinococcus granulosus	cpg binding protein	0.003	0.0294	0.0551
Schistosoma mansoni	hypothetical protein	0.001	0.0023	0.0042
Echinococcus multilocularis	frizzled 4	0.0018	0.0135	0.0253
Echinococcus multilocularis	frizzled	0.0018	0.0135	0.0253
Leishmania major	dihydrolipoamide dehydrogenase, putative	0.0016	0.0106	0.0549
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0046	0.0493	0.0491
Trypanosoma brucei	DNA polymerase IV, putative	0.0041	0.0436	0.8418
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0436	0.8418
Trypanosoma brucei	DNA polymerase eta, putative	0.0015	0.0082	0.1217
Schistosoma mansoni	rab geranylgeranyl transferase alpha subunit	0.0015	0.0082	0.0155
Trypanosoma brucei	DNA polymerase kappa, putative	0.0031	0.0303	0.5715
Loa Loa (eye worm)	hypothetical protein	0.005	0.0553	0.0551
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0041	0.0436	0.8199
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.0119	0.1471	0.4096
Echinococcus granulosus	frizzled	0.0018	0.0135	0.0253
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0016	0.01	0.0097
Echinococcus granulosus	frizzled	0.0018	0.0135	0.0253

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 1870 nM	Inhibition of Smoothened transfected in HEK293 cells by transient transfection cell-based assay	ChEMBL.	20620058
IC50 (binding)	> 5000 nM	Inhibition of Smoothened transfected in HEK293 cells by binding assay	ChEMBL.	20620058

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: CHEMBL1209046

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 1124101