TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 278.698 | Formula: C11H11ClN6O
H donors: 3 H acceptors: 2 LogP: 0.05 Rotable bonds: 3
Rule of 5 violations (Lipinski): 1
SMILES: NC1=NC(OCc2ccc(nc2)Cl)c2c(N1)nc[nH]2
InChi: 1S/C11H11ClN6O/c12-7-2-1-6(3-14-7)4-19-10-8-9(16-5-15-8)17-11(13)18-10/h1-3,5,10H,4H2,(H,15,16)(H3,13,17,18)
InChiKey: OUWXMEZQCVMZDM-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

Species	Target name	Source	Bibliographic reference
Homo sapiens	O-6-methylguanine-DNA methyltransferase	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Candida albicans	6-O-methylguanine-DNA methylase	Get druggable targets OG5_127355	All targets in OG5_127355
Leishmania braziliensis	hypothetical protein, conserved	Get druggable targets OG5_127355	All targets in OG5_127355
Mycobacterium leprae	PROBABLE METHYLATED-DNA--PROTEIN-CYSTEINE METHYLTRANSFERASE OGT (6-O-methylguanine-DNA methyltransferase) (O-6-methylguanine-DNA	Get druggable targets OG5_127355	All targets in OG5_127355
Leishmania donovani	methylated-DNA-[protein]-cysteine S-methyltransferase, putative	Get druggable targets OG5_127355	All targets in OG5_127355
Candida albicans	similar to bacterial Ada regulatory protein	Get druggable targets OG5_127355	All targets in OG5_127355
Trypanosoma cruzi	O-6 methyl-guanine alkyl transferase, putative	Get druggable targets OG5_127355	All targets in OG5_127355
Candida albicans	similar to bacterial Ada regulatory protein	Get druggable targets OG5_127355	All targets in OG5_127355
Trichomonas vaginalis	methylated-DNA--protein-cysteine methyltransferase, putative	Get druggable targets OG5_127355	All targets in OG5_127355
Trypanosoma cruzi	O-6 methyl-guanine alkyl transferase, putative	Get druggable targets OG5_127355	All targets in OG5_127355
Chlamydia trachomatis	methylated-DNA protein-cysteine methyltransferase	Get druggable targets OG5_127355	All targets in OG5_127355
Treponema pallidum	methylated-DNA-protein-cysteine S-methyltransferase (dat)	Get druggable targets OG5_127355	All targets in OG5_127355
Mycobacterium tuberculosis	Methylated-DNA--protein-cysteine methyltransferase Ogt (6-O-methylguanine-DNA methyltransferase) (O-6-methylguanine-DNA-alkyltra	Get druggable targets OG5_127355	All targets in OG5_127355
Leishmania major	hypothetical protein, conserved	Get druggable targets OG5_127355	All targets in OG5_127355
Leishmania infantum	hypothetical protein, conserved	Get druggable targets OG5_127355	All targets in OG5_127355
Leishmania mexicana	hypothetical protein, conserved	Get druggable targets OG5_127355	All targets in OG5_127355
Candida albicans	6-O-methylguanine-DNA methylase	Get druggable targets OG5_127355	All targets in OG5_127355
Mycobacterium ulcerans	methylated-DNA--protein-cysteine methyltransferase Ogt	Get druggable targets OG5_127355	All targets in OG5_127355

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
Schistosoma mansoni	hypothetical protein	0.0021	0.0014	0.0088
Schistosoma mansoni	3-hydroxyacyl-CoA dehydrogenase	0.0117	0.0582	0.3642
Toxoplasma gondii	4'-phosphopantetheinyl transferase domain-containing protein	0.0048	0.0171	0.6914
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0248	0.1042
Brugia malayi	hypothetical protein	0.0021	0.0014	0.0059
Mycobacterium tuberculosis	Probable fructose-bisphosphate aldolase Fba	0.0151	0.0783	0.1335
Mycobacterium tuberculosis	Probable penicillin-binding protein PbpA	0.1013	0.5864	1
Schistosoma mansoni	loxhd1	0.0021	0.0014	0.0088
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0309	0.1717	0.3727
Brugia malayi	Doublecortin family protein	0.0021	0.0014	0.0059
Trypanosoma brucei	DNA polymerase kappa, putative	0.0043	0.0147	0.2148
Wolbachia endosymbiont of Brugia malayi	4'-phosphopantetheinyl transferase	0.0048	0.0171	0.0171
Schistosoma mansoni	rab6-interacting	0.0021	0.0014	0.0088
Brugia malayi	Pre-SET motif family protein	0.0422	0.238	1
Loa Loa (eye worm)	AGC/RSK/RSK protein kinase	0.0109	0.0533	0.2239
Plasmodium vivax	multidomain scavenger receptor, putative	0.0021	0.0014	0.0566
Trypanosoma brucei	DNA polymerase kappa, putative	0.0033	0.0085	0.1239
Echinococcus granulosus	histone lysine methyltransferase setb	0.0061	0.0248	0.2791
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.0117	0.0582	0.0993
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0309	0.1717	0.3727
Chlamydia trachomatis	methylated-DNA protein-cysteine methyltransferase	0.0077	0.0343	0.0175
Schistosoma mansoni	lipoxygenase	0.0125	0.0628	0.3926
Mycobacterium ulcerans	bifunctional membrane-associated penicillin-binding protein 1A/1B PonA2	0.055	0.3136	0.3633
Loa Loa (eye worm)	glutaminase 2	0.0289	0.1598	0.6715
Trypanosoma brucei	DNA polymerase IV, putative	0.0043	0.0147	0.2148
Onchocerca volvulus		0.0169	0.0888	0.3226
Mycobacterium tuberculosis	Probable bifunctional membrane-associated penicillin-binding protein 1A/1B PonA2 (murein polymerase) [includes: penicillin-insen	0.055	0.3136	0.5348
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0117	0.0582	0.0674
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0061	0.0248	0.2791
Leishmania major	3-oxoacyl-(acyl-carrier protein) reductase, putative	0.0117	0.0582	0.8482
Trypanosoma cruzi	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0135	0.0686	1
Brugia malayi	Tyrosyl-DNA phosphodiesterase family protein	0.0135	0.0686	0.2883
Echinococcus multilocularis	ribosomal protein S6 kinase alpha 3	0.0109	0.0533	0.5999
Brugia malayi	glutaminase DH11.1	0.0289	0.1598	0.6715
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0309	0.1717	0.3727
Schistosoma mansoni	serine/threonine protein kinase	0.0045	0.0154	0.0963
Trypanosoma cruzi	O-6 methyl-guanine alkyl transferase, putative	0.0077	0.0343	0.4999
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0309	0.1717	0.3727
Brugia malayi	3-hydroxyacyl-CoA dehydrogenase type II	0.0117	0.0582	0.2445
Loa Loa (eye worm)	hypothetical protein	0.0169	0.0888	0.3732
Plasmodium falciparum	holo-[acyl-carrier-protein] synthase, putative	0.0048	0.0171	1
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0061	0.0248	1
Mycobacterium leprae	PROBABLE BIFUNCTIONAL MEMBRANE-ASSOCIATED PENICILLIN-BINDING PROTEIN 1A/1B PONA2 (MUREIN POLYMERASE) [INCLUDES: PENICILLIN-INSEN	0.055	0.3136	0.5208
Brugia malayi	hypothetical protein	0.0021	0.0014	0.0059
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0043	0.0147	0.2148
Mycobacterium tuberculosis	Methylated-DNA--protein-cysteine methyltransferase Ogt (6-O-methylguanine-DNA methyltransferase) (O-6-methylguanine-DNA-alkyltra	0.0233	0.1265	0.2158
Giardia lamblia	DINP protein human, muc B family	0.0022	0.0022	0.0131
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0117	0.0582	0.0674
Trichomonas vaginalis	DNA polymerase eta, putative	0.0043	0.0147	0.032
Mycobacterium leprae	Probable penicillin-binding protein PbpA	0.1013	0.5864	1
Echinococcus multilocularis	arachidonate 5 lipoxygenase	0.0125	0.0628	0.7064
Entamoeba histolytica	protein kinase, putative	0.0045	0.0154	0.0897
Wolbachia endosymbiont of Brugia malayi	cell division protein FtsI	0.1714	1	1
Echinococcus granulosus	lipoxygenase domain containing protein	0.0021	0.0014	0.0158
Trypanosoma brucei	unspecified product	0.0036	0.0106	0.1547
Treponema pallidum	fructose-bisphosphate aldolase	0.0309	0.1717	0.1717
Leishmania major	rac serine-threonine kinase, putative,protein kinase, putative	0.0093	0.0442	0.6438
Echinococcus multilocularis	dna polymerase kappa	0.0043	0.0147	0.1659
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0309	0.1717	0.3727
Trichomonas vaginalis	methylated-DNA--protein-cysteine methyltransferase, putative	0.0077	0.0343	0.0745
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0309	0.1717	1
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0043	0.0147	0.2148
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0061	0.0248	0.1551
Mycobacterium ulcerans	DNA-methyltransferase (modification methylase)	0.0031	0.0075	0.0087
Trichomonas vaginalis	glutaminase, putative	0.0289	0.1598	0.347
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0085	0.0357
Trypanosoma brucei	DNA polymerase kappa, putative	0.0043	0.0147	0.2148
Echinococcus multilocularis	transcription factor Dp 1	0.0078	0.0351	0.3954
Trichomonas vaginalis	DNA polymerase IV / kappa, putative	0.0043	0.0147	0.032
Schistosoma mansoni	tyrosyl-DNA phosphodiesterase	0.0135	0.0686	0.4293
Mycobacterium leprae	Probable penicillin-binding membrane protein PbpB	0.0466	0.264	0.4336
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0309	0.1717	1
Giardia lamblia	Kinase, AGC AKT	0.0093	0.0442	0.2574
Leishmania major	tyrosyl-DNA phosphodiesterase 1	0.0135	0.0686	1
Echinococcus granulosus	ribosomal protein S6 kinase alpha 3	0.0109	0.0533	0.5999
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0309	0.1717	0.3727
Trypanosoma brucei	DNA polymerase kappa, putative	0.0033	0.0085	0.1239
Brugia malayi	polk-prov protein	0.0033	0.0085	0.0357
Mycobacterium ulcerans	penicillin-binding membrane protein PbpB	0.1482	0.8632	1
Echinococcus granulosus	Polycystic kidney disease protein	0.0021	0.0014	0.0158
Trypanosoma brucei	DNA polymerase IV, putative	0.0036	0.0106	0.1547
Echinococcus multilocularis	L aminoadipate semialdehyde	0.0169	0.0888	1
Mycobacterium tuberculosis	Probable penicillin-binding membrane protein PbpB	0.0466	0.264	0.4501
Mycobacterium leprae	PROBABLE BIFUNCTIONAL PENICILLIN-BINDING PROTEIN 1A/1B PONA1 (MUREIN POLYMERASE) (PBP1): PENICILLIN-INSENSITIVE TRANSGLYCOSYLASE	0.0799	0.4606	0.779
Echinococcus granulosus	lipoxygenase domain containing protein	0.0021	0.0014	0.0158
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0061	0.0248	0.1551
Echinococcus multilocularis	RUN	0.0021	0.0014	0.0158
Onchocerca volvulus		0.0061	0.0248	0.0863
Echinococcus granulosus	L aminoadipate semialdehyde	0.0169	0.0888	1
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase I	0.0045	0.0154	0.1732
Mycobacterium ulcerans	DNA polymerase IV	0.0043	0.0147	0.0171
Schistosoma mansoni	glutaminase	0.0289	0.1598	1
Schistosoma mansoni	rab6-interacting	0.0021	0.0014	0.0088
Mycobacterium ulcerans	penicillin-binding lipoprotein	0.0315	0.1748	0.2025
Mycobacterium tuberculosis	Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed))	0.0022	0.0022	0.0038
Treponema pallidum	methylated-DNA-protein-cysteine S-methyltransferase (dat)	0.0077	0.0343	0.0343
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0043	0.0147	0.2148
Echinococcus granulosus	tyrosyl DNA phosphodiesterase 1	0.0135	0.0686	0.7725
Treponema pallidum	penicillin-binding protein (pbp-1)	0.1714	1	1
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0061	0.0248	0.2791
Schistosoma mansoni	lipoxygenase	0.0087	0.0406	0.2539
Treponema pallidum	penicillin-binding protein (pbp-3)	0.1482	0.8632	0.8632
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0061	0.0248	0.1551
Mycobacterium tuberculosis	Probable bifunctional penicillin-binding protein 1A/1B PonA1 (murein polymerase) (PBP1): penicillin-insensitive transglycosylase	0.0249	0.1361	0.2321
Mycobacterium ulcerans	penicillin-binding protein PbpA	0.1013	0.5864	0.6793
Brugia malayi	aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase	0.0169	0.0888	0.3732
Toxoplasma gondii	4'-phosphopantetheinyl transferase superfamily protein	0.0048	0.0171	0.6914
Leishmania major	DNA polymerase kappa, putative	0.0022	0.0022	0.0328
Echinococcus multilocularis	serine:threonine protein kinase Chk2	0.0045	0.0154	0.1733
Mycobacterium tuberculosis	holo-[acyl-carrier protein] synthase AcpS (holo-ACP synthase) (CoA:APO-[ACP]pantetheinephosphotransferase) (CoA:APO-[acyl-carrie	0.0048	0.0171	0.0292
Mycobacterium ulcerans	DNA polymerase IV	0.0043	0.0147	0.0171
Loa Loa (eye worm)	tyrosyl-DNA phosphodiesterase	0.0135	0.0686	0.2883
Trypanosoma brucei	DNA polymerase kappa, putative	0.0043	0.0147	0.2148
Trypanosoma brucei	DNA polymerase kappa, putative	0.0043	0.0147	0.2148
Leishmania major	DNA polymerase kappa, putative,DNA polymerase IV, putative	0.0022	0.0022	0.0328
Echinococcus granulosus	serine:threonine protein kinase Chk2	0.0045	0.0154	0.1733
Trypanosoma brucei	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0135	0.0686	1
Entamoeba histolytica	hypothetical protein	0.0048	0.0171	0.0999
Echinococcus multilocularis	tyrosyl DNA phosphodiesterase 1	0.0135	0.0686	0.7725
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0043	0.0147	0.2148
Trypanosoma brucei	DNA polymerase kappa, putative	0.0043	0.0147	0.2148
Mycobacterium leprae	Probable fructose bisphosphate aldolase Fba	0.0151	0.0783	0.1074
Mycobacterium ulcerans	phosphopantetheinyl transferase, PptII	0.0048	0.0171	0.0199
Trypanosoma brucei	DNA polymerase IV, putative	0.0043	0.0147	0.2148
Entamoeba histolytica	protein kinase, putative	0.0045	0.0154	0.0897
Brugia malayi	ribosomal protein S6 kinase alpha 3	0.0093	0.0442	0.1856
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0422	0.238	1
Mycobacterium ulcerans	fructose-bisphosphate aldolase	0.0151	0.0783	0.0907
Trypanosoma cruzi	O-6 methyl-guanine alkyl transferase, putative	0.0077	0.0343	0.4999
Mycobacterium ulcerans	glutaminase	0.0289	0.1598	0.1852
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0058	0.0235	0.2643
Mycobacterium ulcerans	4'-phosphopantetheinyl transferase	0.0048	0.0171	0.0199
Loa Loa (eye worm)	glutaminase	0.0289	0.1598	0.6715
Giardia lamblia	Fructose-bisphosphate aldolase	0.0309	0.1717	1
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0309	0.1717	0.3727
Trypanosoma brucei	DNA polymerase kappa, putative	0.0043	0.0147	0.2148
Trichomonas vaginalis	set domain proteins, putative	0.048	0.2724	0.5915
Loa Loa (eye worm)	3-hydroxyacyl-CoA dehydrogenase type II	0.0109	0.0536	0.225
Schistosoma mansoni	serine/threonine protein kinase	0.0109	0.0533	0.3334
Mycobacterium ulcerans	methylated-DNA--protein-cysteine methyltransferase Ogt	0.0233	0.1265	0.1466
Mycobacterium leprae	PROBABLE METHYLATED-DNA--PROTEIN-CYSTEINE METHYLTRANSFERASE OGT (6-O-methylguanine-DNA methyltransferase) (O-6-methylguanine-DNA	0.0233	0.1265	0.1922
Echinococcus granulosus	arachidonate 5 lipoxygenase	0.0125	0.0628	0.7064
Entamoeba histolytica	tyrosyl-DNA phosphodiesterase, putative	0.0135	0.0686	0.3998
Trypanosoma brucei	hypothetical protein, conserved	0.0031	0.0075	0.1089
Echinococcus multilocularis	Polycystic kidney disease protein	0.0021	0.0014	0.0158
Loa Loa (eye worm)	doublecortin family protein	0.0021	0.0014	0.0059
Treponema pallidum	penicillin-binding protein (pbp-2)	0.0799	0.4606	0.4606
Trypanosoma brucei	hypothetical protein, conserved	0.0048	0.0171	0.2498
Trypanosoma cruzi	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0135	0.0686	1
Echinococcus granulosus	RUN	0.0021	0.0014	0.0158
Leishmania major	phosphopantetheinyl transferase-like protein	0.0048	0.0171	0.2498
Trypanosoma brucei	DNA polymerase kappa, putative	0.0022	0.0022	0.0328
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0061	0.0248	0.1551
Mycobacterium ulcerans	bifunctional penicillin-binding protein 1A/1B PonA1	0.0799	0.4606	0.5336
Mycobacterium leprae	POSSIBLE PENICILLIN-BINDING LIPOPROTEIN	0.0315	0.1748	0.2769
Chlamydia trachomatis	transglycolase/transpeptidase	0.0781	0.4497	0.4401
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0309	0.1717	0.3727
Plasmodium vivax	holo-[acyl-carrier-protein] synthase, putative	0.0048	0.0171	0.6914
Mycobacterium tuberculosis	Possible penicillin-binding lipoprotein	0.0315	0.1748	0.2981
Onchocerca volvulus		0.048	0.2724	1
Echinococcus granulosus	3 hydroxyacyl coenzyme A dehydrogenase type 2	0.0117	0.0582	0.6552
Echinococcus multilocularis	lipoxygenase domain containing protein	0.0021	0.0014	0.0158
Echinococcus granulosus	calcium:calmodulin dependent protein kinase I	0.0045	0.0154	0.1732
Plasmodium falciparum	LCCL domain-containing protein	0.0021	0.0014	0.0818
Schistosoma mansoni	aminoadipate-semialdehyde dehydrogenase	0.0169	0.0888	0.5558
Trypanosoma brucei	DNA polymerase kappa, putative	0.0043	0.0147	0.2148
Echinococcus multilocularis	lipoxygenase domain containing protein	0.0021	0.0014	0.0158
Echinococcus granulosus	transcription factor Dp 1	0.0078	0.0351	0.3954
Schistosoma mansoni	polycystin 1-related	0.0021	0.0014	0.0088
Echinococcus multilocularis	3 hydroxyacyl coenzyme A dehydrogenase type 2	0.0117	0.0582	0.6552
Plasmodium vivax	SET domain protein, putative	0.0061	0.0248	1
Treponema pallidum	4'-phosphopantetheinyl transferase	0.0048	0.0171	0.0171
Leishmania major	hypothetical protein, conserved	0.0077	0.0343	0.4999
Echinococcus granulosus	dna polymerase kappa	0.0043	0.0147	0.1659
Trichomonas vaginalis	conserved hypothetical protein	0.0799	0.4606	1
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0014	0.0059
Trypanosoma brucei	DNA polymerase kappa, putative	0.0043	0.0147	0.2148
Brugia malayi	Pre-SET motif family protein	0.0061	0.0248	0.1042
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0014	0.0059
Trypanosoma brucei	DNA polymerase kappa, putative	0.0043	0.0147	0.2148

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 0.12 uM	O6-Alkylguanine-DNA Alkyltransferase-Inactivating Activity in Raji cells (Concentration of inactivator required to produce 50% reduction in ATPase activity)	ChEMBL.	9857094
IC50 (binding)	= 0.12 uM	O6-Alkylguanine-DNA Alkyltransferase-Inactivating Activity in Raji cells (Concentration of inactivator required to produce 50% reduction in ATPase activity)	ChEMBL.	9857094
IC50 (binding)	= 0.2 uM	O6-Alkylguanine-DNA Alkyltransferase-Inactivating Activity (Concentration of inactivator required to produce 50% reduction in ATPase activity)	ChEMBL.	9857094
IC50 (binding)	= 0.2 uM	O6-Alkylguanine-DNA Alkyltransferase-Inactivating Activity (Concentration of inactivator required to produce 50% reduction in ATPase activity)	ChEMBL.	9857094
T1/2 (ADMET)	> 48 hr	In vitro half-life of the compound at 37 degree centigrade in phosphate-buffered saline(PBS; pH =7-7.2)	ChEMBL.	9857094

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: CHEMBL151785

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 257820