TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 345.373 | Formula: C16H15N3O4S
H donors: 0 H acceptors: 4 LogP: 1.21 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: N#Cc1ccc(cc1)Oc1ccc(cn1)S(=O)(=O)N1CCOCC1
InChi: 1S/C16H15N3O4S/c17-11-13-1-3-14(4-2-13)23-16-6-5-15(12-18-16)24(20,21)19-7-9-22-10-8-19/h1-6,12H,7-10H2
InChiKey: FHPQTVALUVFIMC-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
Escherichia coli	penicillin-binding protein	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Mycobacterium tuberculosis	Possible penicillin-binding protein	Get druggable targets OG5_149948	All targets in OG5_149948

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
Loa Loa (eye worm)	hypothetical protein	0.0253	0.0598	0.0598
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.0032	0.0037
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0017	0.0018	0.002
Plasmodium falciparum	lysine-specific histone demethylase 1, putative	0.0253	0.0598	1
Schistosoma mansoni	acetylcholinesterase	0.0036	0.0065	0.0065
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0036	0.0065	0.0065
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.0032	0.0037
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0023	0.0032	0.004
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0082	0.0082
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0023	0.0032	0.004
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0018	0.0018
Trypanosoma brucei	cytochrome P450, putative	0.0035	0.0062	0.7508
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0016	0.0016	0.0019
Toxoplasma gondii	ABC1 family protein	0.0043	0.0082	0.1374
Echinococcus granulosus	neuroligin	0.0036	0.0065	0.0065
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0043	0.0082	0.01
Trichomonas vaginalis	D-aminoacylase, putative	0.0043	0.0082	1
Echinococcus multilocularis	BC026374 protein (S09 family)	0.0036	0.0065	0.0065
Loa Loa (eye worm)	hypothetical protein	0.0253	0.0598	0.0598
Echinococcus multilocularis	protein dispatched 1	0.0047	0.0092	0.0092
Onchocerca volvulus		0.0253	0.0598	0.0567
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0077	0.0077
Plasmodium vivax	protoporphyrinogen oxidase, putative	0.0253	0.0598	1
Giardia lamblia	Ceramide glucosyltransferase	0.1846	0.452	0.5
Echinococcus granulosus	sterol regulatory element binding protein	0.0042	0.0077	0.0077
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0032	0.0032
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0065	0.0065
Mycobacterium ulcerans	dehydrogenase	0.0253	0.0598	0.0678
Trichomonas vaginalis	D-aminoacylase, putative	0.0043	0.0082	1
Onchocerca volvulus	Ceramide glucosyltransferase homolog	0.4073	1	1
Mycobacterium tuberculosis	Possible oxidoreductase	0.0253	0.0598	0.0729
Plasmodium falciparum	conserved Plasmodium protein, unknown function	0.0253	0.0598	1
Mycobacterium ulcerans	beta-lactamase	0.0043	0.0082	0.0093
Loa Loa (eye worm)	hypothetical protein	0.0216	0.0506	0.0506
Trypanosoma cruzi	cytochrome P450, putative	0.0035	0.0062	0.1032
Echinococcus granulosus	para nitrobenzyl esterase	0.0036	0.0065	0.0065
Loa Loa (eye worm)	hypothetical protein	0.0253	0.0598	0.0598
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0043	0.0082	0.0082
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0065	0.0065
Brugia malayi	Carboxylesterase family protein	0.0216	0.0506	0.0506
Trypanosoma cruzi	UDP-galactopyranose mutase	0.0253	0.0598	1
Schistosoma mansoni	ceramide glucosyltransferase	0.4073	1	1
Echinococcus multilocularis		0.0253	0.0598	0.0598
Schistosoma mansoni	Protoporphyrinogen oxidase chloroplast/mitochondrial precursor	0.0253	0.0598	0.0598
Mycobacterium tuberculosis	Probable esterase LipL	0.0043	0.0082	0.01
Echinococcus granulosus	ceramide glucosyltransferase	0.4073	1	1
Echinococcus granulosus	acetylcholinesterase	0.0216	0.0506	0.0506
Schistosoma mansoni	neuroligin 3 (S09 family)	0.0036	0.0065	0.0065
Brugia malayi	AMP-binding enzyme family protein	0.0023	0.0032	0.0032
Mycobacterium ulcerans	flavin-containing monoamine oxidase AofH	0.3591	0.8814	1
Echinococcus multilocularis	ceramide glucosyltransferase	0.4073	1	1
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0043	0.0082	0.0082
Mycobacterium tuberculosis	Carboxylesterase LipT	0.0036	0.0065	0.0079
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.0032	0.0037
Mycobacterium tuberculosis	Probable flavin-containing monoamine oxidase AofH (amine oxidase) (MAO)	0.3338	0.8192	1
Mycobacterium ulcerans	hypothetical protein	0.0043	0.0082	0.0093
Echinococcus granulosus	Protein patched homolog 1	0.0042	0.0077	0.0077
Brugia malayi	beta-lactamase family protein	0.0043	0.0082	0.0082
Mycobacterium ulcerans	oxidoreductase	0.0253	0.0598	0.0678
Schistosoma mansoni	gliotactin	0.0036	0.0065	0.0065
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0016	0.0016	0.0019
Mycobacterium leprae	Probable lipase LipE	0.0043	0.0082	0.1374
Brugia malayi	Carboxylesterase family protein	0.0036	0.0065	0.0065
Echinococcus granulosus	expressed conserved protein	0.0091	0.0199	0.0199
Loa Loa (eye worm)	transcription factor SMAD2	0.0117	0.0264	0.0264
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0032	0.0032
Echinococcus multilocularis	sterol regulatory element binding protein	0.0042	0.0077	0.0077
Mycobacterium leprae	conserved hypothetical protein	0.0043	0.0082	0.1374
Loa Loa (eye worm)	beta-lactamase	0.0043	0.0082	0.0082
Mycobacterium ulcerans	protoporphyrinogen oxidase	0.0253	0.0598	0.0678
Trypanosoma cruzi	hypothetical protein, conserved	0.0043	0.0082	0.1374
Onchocerca volvulus		0.0043	0.0082	0.005
Trypanosoma cruzi	hypothetical protein, conserved	0.0043	0.0082	0.1374
Toxoplasma gondii	histone lysine-specific demethylase LSD1/BHC110/KDMA1A	0.0253	0.0598	1
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0065	0.0065
Trypanosoma cruzi	UDP-galactopyranose mutase	0.0253	0.0598	1
Brugia malayi	Niemann-Pick C1 protein precursor	0.0097	0.0213	0.0213
Brugia malayi	AMP-binding enzyme family protein	0.0023	0.0032	0.0032
Brugia malayi	Cytochrome P450 family protein	0.0035	0.0062	0.0062
Mycobacterium ulcerans	lipase LipD	0.0043	0.0082	0.0093
Echinococcus multilocularis	Niemann Pick C1 protein	0.0138	0.0316	0.0316
Loa Loa (eye worm)	carboxylesterase	0.0036	0.0065	0.0065
Chlamydia trachomatis	protoporphyrinogen oxidase	0.0253	0.0598	1
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0036	0.0065	0.0079
Mycobacterium ulcerans	monoamine oxidase	0.0253	0.0598	0.0678
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0016	0.0016	0.0019
Schistosoma mansoni	amine oxidase	0.0253	0.0598	0.0598
Brugia malayi	MH2 domain containing protein	0.0117	0.0264	0.0264
Plasmodium vivax	hypothetical protein, conserved	0.0253	0.0598	1
Echinococcus multilocularis	neuroligin	0.0036	0.0065	0.0065
Loa Loa (eye worm)	ceramide glucosyltransferase	0.4073	1	1
Echinococcus multilocularis	acetylcholinesterase	0.0216	0.0506	0.0506
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0017	0.0018	0.0022
Onchocerca volvulus		0.0036	0.0065	0.0032
Leishmania major	UDP-galactopyranose mutase	0.0253	0.0598	1
Loa Loa (eye worm)	hypothetical protein	0.0253	0.0598	0.0598
Brugia malayi	hypothetical protein	0.0253	0.0598	0.0598
Plasmodium falciparum	protoporphyrinogen oxidase	0.0253	0.0598	1
Loa Loa (eye worm)	MH2 domain-containing protein	0.0117	0.0264	0.0264
Schistosoma mansoni	ceramide glucosyltransferase	0.4073	1	1
Trichomonas vaginalis	conserved hypothetical protein	0.0042	0.0077	0.7237
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0043	0.0082	0.0082
Schistosoma mansoni	hypothetical protein	0.004	0.0074	0.0074
Trypanosoma cruzi	cytochrome P450, putative	0.0035	0.0062	0.1032
Brugia malayi	Carboxylesterase family protein	0.0036	0.0065	0.0065
Echinococcus granulosus	Niemann Pick C1 protein	0.0138	0.0316	0.0316
Echinococcus granulosus	beta LACTamase domain containing family member	0.0043	0.0082	0.0082
Brugia malayi	Carboxylesterase family protein	0.0216	0.0506	0.0506
Echinococcus granulosus	carboxylesterase 5A	0.0216	0.0506	0.0506
Echinococcus multilocularis	acetylcholinesterase	0.0216	0.0506	0.0506
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0018	0.0018
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0043	0.0082	0.0093
Leishmania major	4-coumarate:coa ligase-like protein	0.0023	0.0032	0.0543
Mycobacterium ulcerans	flavin-containing monoamine oxidase AofH	0.3591	0.8814	1
Schistosoma mansoni	Lysine-specific histone demethylase 1	0.0253	0.0598	0.0598
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0082	0.0082
Leishmania major	4-coumarate:coa ligase-like protein	0.0023	0.0032	0.0543
Loa Loa (eye worm)	carboxylesterase	0.0216	0.0506	0.0506
Loa Loa (eye worm)	CYP4Cod1	0.0035	0.0062	0.0062
Mycobacterium ulcerans	carboxylesterase, LipT	0.0036	0.0065	0.0073
Schistosoma mansoni	hypothetical protein	0.004	0.0074	0.0074
Mycobacterium tuberculosis	Conserved protein	0.0043	0.0082	0.01
Brugia malayi	hypothetical protein	0.0036	0.0065	0.0065
Loa Loa (eye worm)	hypothetical protein	0.0253	0.0598	0.0598
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0043	0.0082	0.0082
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0016	0.0016	0.0019
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0018	0.0018
Brugia malayi	AMP-binding enzyme family protein	0.0023	0.0032	0.0032
Entamoeba histolytica	Niemann-Pick C1 protein, putative	0.0097	0.0213	1
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0216	0.0506	0.0506
Echinococcus multilocularis	lysine specific histone demethylase 1A	0.0253	0.0598	0.0598
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0023	0.0032	0.0543
Echinococcus granulosus	lysine specific histone demethylase 1A	0.0253	0.0598	0.0598
Loa Loa (eye worm)	hypothetical protein	0.0097	0.0213	0.0213
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0023	0.0032	0.0037
Echinococcus multilocularis	family S9 non peptidase ue (S09 family)	0.0036	0.0065	0.0065
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0082	0.0082
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0065	0.0065
Brugia malayi	Carboxylesterase family protein	0.0036	0.0065	0.0065
Mycobacterium tuberculosis	Conserved protein	0.0043	0.0082	0.01
Mycobacterium tuberculosis	Probable lipase LipD	0.0043	0.0082	0.01
Mycobacterium tuberculosis	Probable hydrolase	0.0043	0.0082	0.01
Echinococcus multilocularis	protoporphyrinogen oxidase	0.0253	0.0598	0.0598
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0065	0.0065
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0036	0.0065	0.0065
Schistosoma mansoni	hypothetical protein	0.004	0.0074	0.0074
Loa Loa (eye worm)	abnormal chemotaxis protein 14	0.0042	0.0077	0.0077
Schistosoma mansoni	niemann-pick C1 (NPC1)	0.0098	0.0217	0.0217
Echinococcus multilocularis	expressed conserved protein	0.0091	0.0199	0.0199
Mycobacterium ulcerans	cytochrome P450 185A4 Cyp185A4	0.0035	0.0062	0.007
Trichomonas vaginalis	penicillin-binding protein, putative	0.0043	0.0082	1
Schistosoma mansoni	hypothetical protein	0.004	0.0074	0.0074
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0018	0.0018
Loa Loa (eye worm)	hypothetical protein	0.0216	0.0506	0.0506
Onchocerca volvulus		0.0036	0.0065	0.0032
Echinococcus multilocularis	Niemann Pick C1 protein	0.0097	0.0213	0.0213
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0065	0.0065
Brugia malayi	beta-lactamase	0.0043	0.0082	0.0082
Brugia malayi	SWIRM domain containing protein	0.0253	0.0598	0.0598
Echinococcus multilocularis	protein patched	0.0042	0.0077	0.0077
Brugia malayi	amine oxidase, flavin-containing family protein	0.0253	0.0598	0.0598
Echinococcus granulosus	BC026374 protein S09 family	0.0036	0.0065	0.0065
Plasmodium vivax	lysine-specific histone demethylase 1, putative	0.0253	0.0598	1
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0023	0.0032	0.0543
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0032	0.0032
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0043	0.0082	0.01
Mycobacterium ulcerans	hypothetical protein	0.0023	0.0032	0.0037
Plasmodium vivax	hypothetical protein, conserved	0.0043	0.0082	0.1107
Loa Loa (eye worm)	hypothetical protein	0.0253	0.0598	0.0598
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0082	0.0082
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0043	0.0082	0.01
Toxoplasma gondii	histone lysine-specific demethylase	0.0253	0.0598	1
Mycobacterium ulcerans	esterase/lipase LipP	0.0043	0.0082	0.0093
Schistosoma mansoni	amine oxidase	0.0253	0.0598	0.0598
Trichomonas vaginalis	penicillin-binding protein, putative	0.0043	0.0082	1
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0278	0.0659	0.0804
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0082	0.0082
Schistosoma mansoni	BC026374 protein (S09 family)	0.0036	0.0065	0.0065
Onchocerca volvulus		0.0043	0.0082	0.005
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0023	0.0032	0.0037
Echinococcus multilocularis	carboxylesterase 5A	0.0216	0.0506	0.0506
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0037	0.0037
Leishmania major	4-coumarate:coa ligase-like protein	0.0023	0.0032	0.0543
Trypanosoma brucei	hypothetical protein, conserved	0.0043	0.0082	1
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0036	0.0065	0.0079
Leishmania major	cytochrome p450-like protein	0.0035	0.0062	0.1032
Echinococcus granulosus	Niemann Pick C1 protein	0.0097	0.0213	0.0213
Loa Loa (eye worm)	acetylcholinesterase 1	0.0216	0.0506	0.0506
Loa Loa (eye worm)	cytochrome P450 family protein	0.0035	0.0062	0.0062
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0023	0.0032	0.0037
Loa Loa (eye worm)	carboxylesterase	0.0036	0.0065	0.0065
Onchocerca volvulus		0.0036	0.0065	0.0032
Loa Loa (eye worm)	cytochrome P450 family protein	0.0035	0.0062	0.0062
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0023	0.0032	0.0037
Leishmania major	hypothetical protein, conserved	0.0043	0.0082	0.1374
Brugia malayi	beta-lactamase family protein	0.0043	0.0082	0.0082
Echinococcus multilocularis	para nitrobenzyl esterase	0.0036	0.0065	0.0065
Echinococcus multilocularis	atpase aaa+ type core atpase aaa type core	0.0797	0.1937	0.1937
Brugia malayi	CHE-14 protein	0.0042	0.0077	0.0077
Trichomonas vaginalis	D-aminoacylase, putative	0.0043	0.0082	1
Mycobacterium tuberculosis	Probable lipase LipE	0.0043	0.0082	0.01
Onchocerca volvulus		0.0036	0.0065	0.0032
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0253	0.0598	0.0729
Mycobacterium tuberculosis	Conserved protein	0.0043	0.0082	0.01
Brugia malayi	Carboxylesterase family protein	0.0036	0.0065	0.0065
Onchocerca volvulus		0.0036	0.0065	0.0032
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0065	0.0065
Plasmodium vivax	hypothetical protein, conserved	0.0253	0.0598	1
Loa Loa (eye worm)	hypothetical protein	0.0051	0.01	0.01
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0018	0.0018
Trichomonas vaginalis	esterase, putative	0.0043	0.0082	1
Echinococcus granulosus	acetylcholinesterase	0.0216	0.0506	0.0506
Onchocerca volvulus		0.0043	0.0082	0.005
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0043	0.0082	0.0082
Mycobacterium leprae	PROBABLE PROTOPORPHYRINOGEN OXIDASE HEMY (PROTOPORPHYRINOGEN-IX OXIDASE) (PROTOPORPHYRINOGENASE) (PPO)	0.0253	0.0598	1
Schistosoma mansoni	patched 1	0.0042	0.0077	0.0077
Echinococcus granulosus	family S9 non peptidase ue S09 family	0.0036	0.0065	0.0065
Brugia malayi	Cytochrome P450 family protein	0.0035	0.0062	0.0062
Echinococcus granulosus	lysine specific histone demethylase 1A	0.0253	0.0598	0.0598
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0082	0.0082
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0036	0.0065	0.0065

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	= 0.631 um	PUBCHEM_BIOASSAY: qHTS Inhibitors of AmpC Beta-Lactamase (assay with detergent). (Class of assay: confirmatory) [Related pubchem assays: 1002 (Confirmation Concentration-Response Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent)), 585 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay without detergent) - a screen old NIH MLSMR collection), 584 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay with detergent) - a screen of the old NIH MLSMR collection), 1003 (Confirmation Cuvette-Based Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent))]	ChEMBL.	No reference
Potency (functional)	11.6891 uM	PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850]	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Plasmodium falciparum	ChEMBL23

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: CHEMBL1513721

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 1376848